1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine

C95H201N9 — CID 158771271

IUPAC1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine
SMILESC.CC(C)CC1CCN(C(C)C)CC1.CC(C)CC1CCN(C)CC1.CC(C)CCC1CCN(C(C)C)CC1.CC(C)CCC1CCN(C)CC1.CCC(CC1CCN(C)CC1)C(C)C.CCC(CN1CCN(C)CC1)C(C)C.CCN1CCC(CC(C)C)CC1.CCN1CCC(CCC(C)C)CC1
InChIInChI=1S/2C13H27N.C12H26N2.2C12H25N.2C11H23N.C10H21N.CH4/c1-11(2)5-6-13-7-9-14(10-8-13)12(3)4;1-5-13(11(2)3)10-12-6-8-14(4)9-7-12;1-5-12(11(2)3)10-14-8-6-13(4)7-9-14;1-10(2)9-12-5-7-13(8-6-12)11(3)4;1-4-13-9-7-12(8-10-13)6-5-11(2)3;1-10(2)4-5-11-6-8-12(3)9-7-11;1-4-12-7-5-11(6-8-12)9-10(2)3;1-9(2)8-10-4-6-11(3)7-5-10;/h2*11-13H,5-10H2,1-4H3;11-12H,5-10H2,1-4H3;10-12H,5-9H2,1-4H3;11-12H,4-10H2,1-3H3;2*10-11H,4-9H2,1-3H3;9-10H,4-8H2,1-3H3;1H4
InChIKeyIPWYGSCMMDVENZ-UHFFFAOYSA-N
MW1469.72 g/mol
LogP23.71
Rot. Bonds27

About 1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine

1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine (PubChem CID 158771271) has the molecular formula C95H201N9 and a molecular weight of 1469.72 g/mol. Its IUPAC name is 1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine
PubChem CID158771271
Molecular FormulaC95H201N9
Molecular Weight1469.72 g/mol
Exact Mass1468.60
IUPAC Name1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine
SMILESC.CC(C)CC1CCN(C(C)C)CC1.CC(C)CC1CCN(C)CC1.CC(C)CCC1CCN(C(C)C)CC1.CC(C)CCC1CCN(C)CC1.CCC(CC1CCN(C)CC1)C(C)C.CCC(CN1CCN(C)CC1)C(C)C.CCN1CCC(CC(C)C)CC1.CCN1CCC(CCC(C)C)CC1
InChIInChI=1S/2C13H27N.C12H26N2.2C12H25N.2C11H23N.C10H21N.CH4/c1-11(2)5-6-13-7-9-14(10-8-13)12(3)4;1-5-13(11(2)3)10-12-6-8-14(4)9-7-12;1-5-12(11(2)3)10-14-8-6-13(4)7-9-14;1-10(2)9-12-5-7-13(8-6-12)11(3)4;1-4-13-9-7-12(8-10-13)6-5-11(2)3;1-10(2)4-5-11-6-8-12(3)9-7-11;1-4-12-7-5-11(6-8-12)9-10(2)3;1-9(2)8-10-4-6-11(3)7-5-10;/h2*11-13H,5-10H2,1-4H3;11-12H,5-10H2,1-4H3;10-12H,5-9H2,1-4H3;11-12H,4-10H2,1-3H3;2*10-11H,4-9H2,1-3H3;9-10H,4-8H2,1-3H3;1H4
InChIKeyIPWYGSCMMDVENZ-UHFFFAOYSA-N
XLogP23.71
TPSA29.16 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds27
Heavy Atoms104
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001469.72
LogP ≤ 523.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine with MolForge

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Related Compounds

3,3-difluoro-5-propan-2-ylpiperidin-1-ide;(5R)-3,3-difluoro-5-propan-2-ylpiperidin-1-ide;(5S)-3,3-difluoro-5-propan-2-ylpiperidin-1-ide;2-methyl-5-propan-2-ylpiperidin-1-ide;(2S,5S)-2-methyl-5-propan-2-ylpiperidin-1-ide;(2R,5S)-2-methyl-5-propan-2-ylpiperidin-1-ide;bis((2S,5R)-2-methyl-5-propan-2-ylpiperidin-1-ide);propane;octakis(yttrium)
CID 161421397
Bis(2,2-difluoro-1,4-di(propan-2-yl)piperidine);bis(3,3-difluoro-1,4-di(propan-2-yl)piperidine);1,4-di(propan-2-yl)piperazine;1,2-di(propan-2-yl)piperidine;1,3-di(propan-2-yl)piperidine;bis(1,4-di(propan-2-yl)piperidine)
CID 164947690
3-Methyl-1-[7-(3-methyl-1-azoniabicyclo[2.2.2]octan-1-yl)heptyl]-1-azoniabicyclo[2.2.2]octane
CID 3063634
2-(1-Azabicyclo[2.2.2]octan-2-yl)-1-azabicyclo[2.2.2]octane
CID 19833051
1-[1,3-Bis[4-(1,1-dimethylpiperidin-1-ium-4-yl)-1-methylpiperidin-1-ium-1-yl]propan-2-yl]-4-[1-[1,3-bis[4-(1,1-dimethylpiperidin-1-ium-4-yl)-1-methylpiperidin-1-ium-1-yl]propan-2-yl]-1-methylpiperidin-1-ium-4-yl]-1-methylpiperidin-1-ium
CID 54501538
1-Hexadecyl-4-[6-(4-hexadecyl-1,4-diazoniabicyclo[2.2.2]octan-1-yl)-2,3,4,5-tetramethylhexyl]-1,4-diazoniabicyclo[2.2.2]octane
CID 57831551
2-[8-(1-Azabicyclo[2.2.2]octan-2-yl)octyl]-1-azabicyclo[2.2.2]octane
CID 67223616
1-methyl-N-(1-methylpiperidin-4-yl)-N-[1,2,2-tris(1-methylpiperidin-4-yl)ethyl]piperidin-4-amine
CID 67680689
N-[1,1-bis(1-methylpiperidin-4-yl)tetradecan-2-yl]-1-methyl-N-(1-methylpiperidin-4-yl)piperidin-4-amine
CID 67680691
N'-[2-(6-aminohexylamino)ethyl]-N,N,1,1-tetrakis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine;N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)hexane-1,6-diamine
CID 88787024
1-Methyl-4-[[4-[2-[4-[2-[4-[2-[1-[2-(4-methylpiperidin-1-yl)ethyl]piperidin-4-yl]ethyl]piperidin-1-yl]ethyl]piperidin-1-yl]ethyl]piperidin-1-yl]methyl]piperidine
CID 135279336
N-[2-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N,N',N'-tris(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,2-diamine
CID 140348178

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine?
The IUPAC name of 1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine (CID 158771271) is 1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine.
What is the SMILES notation for 1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine?
The canonical SMILES for 1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine is C.CC(C)CC1CCN(C(C)C)CC1.CC(C)CC1CCN(C)CC1.CC(C)CCC1CCN(C(C)C)CC1.CC(C)CCC1CCN(C)CC1.CCC(CC1CCN(C)CC1)C(C)C.CCC(CN1CCN(C)CC1)C(C)C.CCN1CCC(CC(C)C)CC1.CCN1CCC(CCC(C)C)CC1.
What is the InChIKey of 1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine?
The InChIKey is IPWYGSCMMDVENZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C13H27N.C12H26N2.2C12H25N.2C11H23N.C10H21N.CH4/c1-11(2)5-6-13-7-9-14(10-8-13)12(3)4;1-5-13(11(2)3)10-12-6-8-14(4)9-7-12;1-5-12(11(2)3)10-14-8-6-13(4)7-9-14;1-10(2)9-12-5-7-13(8-6-12)11(3)4;1-4-13-9-7-12(8-10-13)6-5-11(2)3;1-10(2)4-5-11-6-8-12(3)9-7-11;1-4-12-7-5-11(6-8-12)9-10(2)3;1-9(2)8-10-4-6-11(3)7-5-10;/h2*11-13H,5-10H2,1-4H3;11-12H,5-10H2,1-4H3;10-12H,5-9H2,1-4H3;11-12H,4-10H2,1-3H3;2*10-11H,4-9H2,1-3H3;9-10H,4-8H2,1-3H3;1H4.
What are the key properties of 1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine?
1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine has a molecular weight of 1469.72 g/mol, XLogP of 23.71, 27 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethyl-3-methylbutyl)-4-methylpiperazine;4-(2-ethyl-3-methylbutyl)-1-methylpiperidine;1-ethyl-4-(3-methylbutyl)piperidine;1-ethyl-4-(2-methylpropyl)piperidine;methane;4-(3-methylbutyl)-1-propan-2-ylpiperidine;1-methyl-4-(3-methylbutyl)piperidine;1-methyl-4-(2-methylpropyl)piperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine is sourced from PubChem (CID 158771271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).