methoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol

C20H43NO3 — CID 174815812

IUPACmethoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol
SMILESCC1CCC(C(C)C)C(O)C1.CCCCCC(C)C(N)=O.COC
InChIInChI=1S/C10H20O.C8H17NO.C2H6O/c1-7(2)9-5-4-8(3)6-10(9)11;1-3-4-5-6-7(2)8(9)10;1-3-2/h7-11H,4-6H2,1-3H3;7H,3-6H2,1-2H3,(H2,9,10);1-2H3
InChIKeySGDMPGOREBYYMB-UHFFFAOYSA-N
MW345.57 g/mol
LogP4.39
Rot. Bonds6

About methoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol

methoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol (PubChem CID 174815812) has the molecular formula C20H43NO3 and a molecular weight of 345.57 g/mol. Its IUPAC name is methoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Namemethoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol
PubChem CID174815812
Molecular FormulaC20H43NO3
Molecular Weight345.57 g/mol
Exact Mass345.32
IUPAC Namemethoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol
SMILESCC1CCC(C(C)C)C(O)C1.CCCCCC(C)C(N)=O.COC
InChIInChI=1S/C10H20O.C8H17NO.C2H6O/c1-7(2)9-5-4-8(3)6-10(9)11;1-3-4-5-6-7(2)8(9)10;1-3-2/h7-11H,4-6H2,1-3H3;7H,3-6H2,1-2H3,(H2,9,10);1-2H3
InChIKeySGDMPGOREBYYMB-UHFFFAOYSA-N
XLogP4.39
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.57
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

dodecanoic acid;5-methyl-2-propan-2-ylcyclohexan-1-ol
CID 122703177
hypochlorous acid;5-methyl-2-propan-2-ylcyclohexan-1-ol
CID 174568794
2-methylheptanamide;2-methylhexanamide
CID 160718848
CID 66630118
CID 66630118
sodium;hydride;2-methyloctanamide
CID 174470127
2-methylhexanamide
CID 2828737
2-hydroxypropanoic acid;(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol;[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2-hydroxypropanoate;hydroxide
CID 159704935
[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (2S)-2-(2-bromo-2-oxoethyl)heptanoate
CID 10430406
(5-methyl-2-propan-2-ylcyclohexyl) 5-amino-2-methylpentanoate
CID 104686009
(5-methyl-2-propan-2-ylcyclohexyl) 6-amino-2-methylheptanoate
CID 65285377
2-O-(5-methyl-2-propan-2-ylcyclohexyl) 1-O-pentyl oxalate
CID 6421326
2-methylicosa-11,14-dienamide
CID 175746328

Frequently Asked Questions

What is the IUPAC name of methoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol?
The IUPAC name of methoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol (CID 174815812) is methoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for methoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for methoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol is CC1CCC(C(C)C)C(O)C1.CCCCCC(C)C(N)=O.COC.
What is the InChIKey of methoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol?
The InChIKey is SGDMPGOREBYYMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O.C8H17NO.C2H6O/c1-7(2)9-5-4-8(3)6-10(9)11;1-3-4-5-6-7(2)8(9)10;1-3-2/h7-11H,4-6H2,1-3H3;7H,3-6H2,1-2H3,(H2,9,10);1-2H3.
What are the key properties of methoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol?
methoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol has a molecular weight of 345.57 g/mol, XLogP of 4.39, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethane;2-methylheptanamide;5-methyl-2-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 174815812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).