3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol

C11H23NO — CID 60969986

IUPAC3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol
SMILESCC1CCCC(N(C)CCCO)C1
InChIInChI=1S/C11H23NO/c1-10-5-3-6-11(9-10)12(2)7-4-8-13/h10-11,13H,3-9H2,1-2H3
InChIKeyYHNAPRQBLCEZMI-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.88
Rot. Bonds4

About 3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol

3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol (PubChem CID 60969986) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol.

Molecular Properties

Compound Name3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol
PubChem CID60969986
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol
SMILESCC1CCCC(N(C)CCCO)C1
InChIInChI=1S/C11H23NO/c1-10-5-3-6-11(9-10)12(2)7-4-8-13/h10-11,13H,3-9H2,1-2H3
InChIKeyYHNAPRQBLCEZMI-UHFFFAOYSA-N
XLogP1.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N,N'-trimethyl-N'-[(1S,3R)-3-methylcyclohexyl]ethane-1,2-diamine
CID 7074573
N-(9-bromononyl)-N,3-dimethylcyclohexan-1-amine
CID 105343672
N',N'-diethyl-N-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine
CID 2846615
methyl 4-[methyl-(3-methylcyclohexyl)amino]butanoate
CID 61446295
2-(cyclopropylamino)-2-methyl-5-[methyl-(3-methylcyclohexyl)amino]pentan-1-ol
CID 64827706
5-[cyclopentyl(methyl)amino]pentan-1-ol
CID 62227665
N-ethyl-N'-methyl-N'-(3-methylcyclohexyl)pentane-1,5-diamine
CID 62429155
1-N-methyl-1-N-(3-methylcyclohexyl)hexane-1,4-diamine
CID 106799546
2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol
CID 102870175
(3S)-N-ethyl-N,3-dimethylcycloheptan-1-amine
CID 171506165
N'-methyl-N'-(3-methylcyclohexyl)-N-(2-methylpropyl)butane-1,4-diamine
CID 62429150
N-cyclopropyl-N'-methyl-N'-(3-methylcyclohexyl)ethane-1,2-diamine
CID 61447072

Frequently Asked Questions

What is the IUPAC name of 3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol?
The IUPAC name of 3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol (CID 60969986) is 3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol.
What is the SMILES notation for 3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol?
The canonical SMILES for 3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol is CC1CCCC(N(C)CCCO)C1.
What is the InChIKey of 3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol?
The InChIKey is YHNAPRQBLCEZMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-10-5-3-6-11(9-10)12(2)7-4-8-13/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol?
3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl-(3-methylcyclohexyl)amino]propan-1-ol is sourced from PubChem (CID 60969986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).