2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate

C162H329N9O27 — CID 167538555

IUPAC2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate
SMILESC.CC(C)C#CCC(C)C.CC(C)CCC(=O)CCCOCCOCCOCCOCCC(=O)CCC(C)C.CC(C)CCC(=O)CCOCCOCCOCCOCCCC(=O)C(C)C.CC(C)CCC(=O)NCC(C)C.CC(C)CCCC(=O)NCC(C)C.CC(C)CCCCC(=O)NCC(C)C.CC(C)CCCCCC(=O)CCCOCCOCCOCCOCCC(=O)CCC(C)C.CC(C)CCCCCC(=O)NCC(C)C.CC(C)CNC(=O)CC(C)C.CC(C)CNC(=O)CCCCNC(C)C.CC(C)CNC(=O)OC(C)C.COCNCC(C)(C)C
InChIInChI=1S/C26H50O6.C23H44O6.C21H40O6.C13H27NO.C12H26N2O.C12H25NO.C11H23NO.C10H21NO.C9H19NO.C9H16.C8H17NO2.C7H17NO.CH4/c1-23(2)9-6-5-7-10-25(27)11-8-15-29-17-19-31-21-22-32-20-18-30-16-14-26(28)13-12-24(3)4;1-20(2)7-9-22(24)6-5-12-26-14-16-28-18-19-29-17-15-27-13-11-23(25)10-8-21(3)4;1-18(2)7-8-20(22)9-11-25-13-15-27-17-16-26-14-12-24-10-5-6-21(23)19(3)4;1-11(2)8-6-5-7-9-13(15)14-10-12(3)4;1-10(2)9-14-12(15)7-5-6-8-13-11(3)4;1-10(2)7-5-6-8-12(14)13-9-11(3)4;1-9(2)6-5-7-11(13)12-8-10(3)4;1-8(2)5-6-10(12)11-7-9(3)4;1-7(2)5-9(11)10-6-8(3)4;1-8(2)6-5-7-9(3)4;1-6(2)5-9-8(10)11-7(3)4;1-7(2,3)5-8-6-9-4;/h23-24H,5-22H2,1-4H3;20-21H,5-19H2,1-4H3;18-19H,5-17H2,1-4H3;11-12H,5-10H2,1-4H3,(H,14,15);10-11,13H,5-9H2,1-4H3,(H,14,15);10-11H,5-9H2,1-4H3,(H,13,14);9-10H,5-8H2,1-4H3,(H,12,13);8-9H,5-7H2,1-4H3,(H,11,12);7-8H,5-6H2,1-4H3,(H,10,11);8-9H,6H2,1-4H3;6-7H,5H2,1-4H3,(H,9,10);8H,5-6H2,1-4H3;1H4
InChIKeyAWGZSECIZHKSPK-UHFFFAOYSA-N
MW2835.45 g/mol
LogP34.27
Rot. Bonds112

About 2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate

2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate (PubChem CID 167538555) has the molecular formula C162H329N9O27 and a molecular weight of 2835.45 g/mol. Its IUPAC name is 2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate.

Molecular Properties

Compound Name2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate
PubChem CID167538555
Molecular FormulaC162H329N9O27
Molecular Weight2835.45 g/mol
Exact Mass2833.46
IUPAC Name2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate
SMILESC.CC(C)C#CCC(C)C.CC(C)CCC(=O)CCCOCCOCCOCCOCCC(=O)CCC(C)C.CC(C)CCC(=O)CCOCCOCCOCCOCCCC(=O)C(C)C.CC(C)CCC(=O)NCC(C)C.CC(C)CCCC(=O)NCC(C)C.CC(C)CCCCC(=O)NCC(C)C.CC(C)CCCCCC(=O)CCCOCCOCCOCCOCCC(=O)CCC(C)C.CC(C)CCCCCC(=O)NCC(C)C.CC(C)CNC(=O)CC(C)C.CC(C)CNC(=O)CCCCNC(C)C.CC(C)CNC(=O)OC(C)C.COCNCC(C)(C)C
InChIInChI=1S/C26H50O6.C23H44O6.C21H40O6.C13H27NO.C12H26N2O.C12H25NO.C11H23NO.C10H21NO.C9H19NO.C9H16.C8H17NO2.C7H17NO.CH4/c1-23(2)9-6-5-7-10-25(27)11-8-15-29-17-19-31-21-22-32-20-18-30-16-14-26(28)13-12-24(3)4;1-20(2)7-9-22(24)6-5-12-26-14-16-28-18-19-29-17-15-27-13-11-23(25)10-8-21(3)4;1-18(2)7-8-20(22)9-11-25-13-15-27-17-16-26-14-12-24-10-5-6-21(23)19(3)4;1-11(2)8-6-5-7-9-13(15)14-10-12(3)4;1-10(2)9-14-12(15)7-5-6-8-13-11(3)4;1-10(2)7-5-6-8-12(14)13-9-11(3)4;1-9(2)6-5-7-11(13)12-8-10(3)4;1-8(2)5-6-10(12)11-7-9(3)4;1-7(2)5-9(11)10-6-8(3)4;1-8(2)6-5-7-9(3)4;1-6(2)5-9-8(10)11-7(3)4;1-7(2,3)5-8-6-9-4;/h23-24H,5-22H2,1-4H3;20-21H,5-19H2,1-4H3;18-19H,5-17H2,1-4H3;11-12H,5-10H2,1-4H3,(H,14,15);10-11,13H,5-9H2,1-4H3,(H,14,15);10-11H,5-9H2,1-4H3,(H,13,14);9-10H,5-8H2,1-4H3,(H,12,13);8-9H,5-7H2,1-4H3,(H,11,12);7-8H,5-6H2,1-4H3,(H,10,11);8-9H,6H2,1-4H3;6-7H,5H2,1-4H3,(H,9,10);8H,5-6H2,1-4H3;1H4
InChIKeyAWGZSECIZHKSPK-UHFFFAOYSA-N
XLogP34.27
TPSA459.40 Ų
H-Bond Donors9
H-Bond Acceptors29
Rotatable Bonds112
Heavy Atoms198
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002835.45
LogP ≤ 534.27
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate with MolForge

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Related Compounds

2,9-dimethyldecane-3,7-dione;2,9-dimethyldecane-3,8-dione;2,9-dimethyldecan-3-one;2,11-dimethyldodecane-3,10-dione;2,6-dimethylheptan-3-one;2,5-dimethylhexan-3-one;2,8-dimethylnonane-3,6-dione;2,7-dimethyloctan-3-one;2,4-dimethylpentan-3-one;2-methyl-6-[2-(4-methyl-3-oxopentoxy)ethoxy]hexan-3-one;9-methyl-8-oxo-N-propan-2-yldecanamide;3-methyl-1-(propan-2-ylamino)butan-2-one
CID 167698240
2,15-dimethylhexadecan-3-one;2,13-dimethyltetradecan-3-one;4-methyl-N-(9-methyl-8-oxodecyl)pentanamide;4-methyl-N-(11-methyl-10-oxododecyl)pentanamide;4-methyl-N-(5-methyl-4-oxohexyl)pentanamide;4-methyl-N-(7-methyl-6-oxooctyl)pentanamide;3-methyl-1-[2-[2-(4-methylpentoxy)ethoxy]ethoxy]butan-2-one;4-methyl-1-[2-(4-methylpentoxy)ethoxy]pentan-3-one;N-(9-methyl-8-oxodecyl)-2-propan-2-yloxyacetamide;N-(5-methyl-4-oxohexyl)-2-propan-2-yloxyacetamide;N-(7-methyl-6-oxooctyl)-2-propan-2-yloxyacetamide;2-methyl-10-(propan-2-ylamino)decan-3-one;2-methyl-12-(propan-2-ylamino)dodecan-3-one;3-methyl-1-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]butan-2-one;3-methyl-1-[2-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butan-2-one;2-methyl-8-(propan-2-ylamino)octan-3-one;9-methyl-N-propan-2-yldecan-1-amine;7-methyl-N-propan-2-yloctan-1-amine
CID 165106432
4-(3-methylbutoxy)-N-(7-methyl-6-oxooctyl)butanamide
CID 169317050
6-methyl-N-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethyl]heptanamide
CID 168756309
N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide
CID 146802070
3-methyl-N-(2-methylpropyl)butanamide;propan-2-yl N-(2-methylpropyl)carbamate
CID 162127345
ethane;methane;3-methyl-N-[2-(5-methyl-4-oxohexoxy)ethyl]butanamide
CID 160711041
8-methyl-7-oxo-N-[5-(propan-2-ylamino)pentyl]nonanamide
CID 178094356
2-methyl-6-[2-(7-methyloctoxy)ethoxy]hexan-3-one
CID 164970854
2-methyl-8-[2-[2-(7-methyloctoxy)ethoxy]ethoxy]octan-3-one
CID 170679761
7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one
CID 157073137
N-[2-[2-[6-[2-[5,8-bis(3-methylbutanoylamino)-4-oxooctoxy]ethoxy]-4-oxohexoxy]ethoxy]ethyl]tetradecanamide
CID 159758905

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate?
The IUPAC name of 2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate (CID 167538555) is 2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate.
What is the SMILES notation for 2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate?
The canonical SMILES for 2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate is C.CC(C)C#CCC(C)C.CC(C)CCC(=O)CCCOCCOCCOCCOCCC(=O)CCC(C)C.CC(C)CCC(=O)CCOCCOCCOCCOCCCC(=O)C(C)C.CC(C)CCC(=O)NCC(C)C.CC(C)CCCC(=O)NCC(C)C.CC(C)CCCCC(=O)NCC(C)C.CC(C)CCCCCC(=O)CCCOCCOCCOCCOCCC(=O)CCC(C)C.CC(C)CCCCCC(=O)NCC(C)C.CC(C)CNC(=O)CC(C)C.CC(C)CNC(=O)CCCCNC(C)C.CC(C)CNC(=O)OC(C)C.COCNCC(C)(C)C.
What is the InChIKey of 2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate?
The InChIKey is AWGZSECIZHKSPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H50O6.C23H44O6.C21H40O6.C13H27NO.C12H26N2O.C12H25NO.C11H23NO.C10H21NO.C9H19NO.C9H16.C8H17NO2.C7H17NO.CH4/c1-23(2)9-6-5-7-10-25(27)11-8-15-29-17-19-31-21-22-32-20-18-30-16-14-26(28)13-12-24(3)4;1-20(2)7-9-22(24)6-5-12-26-14-16-28-18-19-29-17-15-27-13-11-23(25)10-8-21(3)4;1-18(2)7-8-20(22)9-11-25-13-15-27-17-16-26-14-12-24-10-5-6-21(23)19(3)4;1-11(2)8-6-5-7-9-13(15)14-10-12(3)4;1-10(2)9-14-12(15)7-5-6-8-13-11(3)4;1-10(2)7-5-6-8-12(14)13-9-11(3)4;1-9(2)6-5-7-11(13)12-8-10(3)4;1-8(2)5-6-10(12)11-7-9(3)4;1-7(2)5-9(11)10-6-8(3)4;1-8(2)6-5-7-9(3)4;1-6(2)5-9-8(10)11-7(3)4;1-7(2,3)5-8-6-9-4;/h23-24H,5-22H2,1-4H3;20-21H,5-19H2,1-4H3;18-19H,5-17H2,1-4H3;11-12H,5-10H2,1-4H3,(H,14,15);10-11,13H,5-9H2,1-4H3,(H,14,15);10-11H,5-9H2,1-4H3,(H,13,14);9-10H,5-8H2,1-4H3,(H,12,13);8-9H,5-7H2,1-4H3,(H,11,12);7-8H,5-6H2,1-4H3,(H,10,11);8-9H,6H2,1-4H3;6-7H,5H2,1-4H3,(H,9,10);8H,5-6H2,1-4H3;1H4.
What are the key properties of 2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate?
2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate has a molecular weight of 2835.45 g/mol, XLogP of 34.27, 112 rotatable bonds, 9 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylhept-3-yne;methane;N-(methoxymethyl)-2,2-dimethylpropan-1-amine;7-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]octan-4-one;10-methyl-1-[2-[2-[2-(6-methyl-3-oxoheptoxy)ethoxy]ethoxy]ethoxy]undecan-4-one;6-methyl-1-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]heptan-3-one;3-methyl-N-(2-methylpropyl)butanamide;6-methyl-N-(2-methylpropyl)heptanamide;5-methyl-N-(2-methylpropyl)hexanamide;7-methyl-N-(2-methylpropyl)octanamide;4-methyl-N-(2-methylpropyl)pentanamide;N-(2-methylpropyl)-5-(propan-2-ylamino)pentanamide;propan-2-yl N-(2-methylpropyl)carbamate is sourced from PubChem (CID 167538555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).