3-cyclohexyl-N-methylpropan-1-amine

C10H21N — CID 3028091

IUPAC3-cyclohexyl-N-methylpropan-1-amine
SMILESCNCCCC1CCCCC1
InChIInChI=1S/C10H21N/c1-11-9-5-8-10-6-3-2-4-7-10/h10-11H,2-9H2,1H3
InChIKeyIILRAHSGEUAOTG-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.57
Rot. Bonds4

About 3-cyclohexyl-N-methylpropan-1-amine

3-cyclohexyl-N-methylpropan-1-amine (PubChem CID 3028091) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 3-cyclohexyl-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-cyclohexyl-N-methylpropan-1-amine
PubChem CID3028091
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name3-cyclohexyl-N-methylpropan-1-amine
SMILESCNCCCC1CCCCC1
InChIInChI=1S/C10H21N/c1-11-9-5-8-10-6-3-2-4-7-10/h10-11H,2-9H2,1H3
InChIKeyIILRAHSGEUAOTG-UHFFFAOYSA-N
XLogP2.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-cyclopentyl-N-methylpropan-1-amine;hydrochloride
CID 75530738
2-cyclohexyl-N-methylethanamine;ethane
CID 171834156
3-cyclotetradecyl-N-propan-2-ylpropan-1-amine
CID 91804535
butylcyclohexane;N-methylmethanamine
CID 174941558
4-cyclopentylbutylcyclohexane
CID 144547696
3-cyclohexadecylpropylcyclohexadecane
CID 57270632
3-[3-fluoro-3-(trifluoromethyl)cyclohexyl]-N-methylpropan-1-amine
CID 84737013
N-(cycloheptylmethyl)-3-cyclopentylpropan-1-amine
CID 106008062
3-cyclobutylpropylcyclohexane
CID 54165208
N-methyl-3-(3-methylcyclobutyl)propan-1-amine
CID 119055096
3-cyclohexyl-N-(1-cyclopropylethyl)propan-1-amine
CID 115676362
3-(cyclopentylmethylsulfinyl)-N-methylpropan-1-amine
CID 64655468

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-methylpropan-1-amine?
The IUPAC name of 3-cyclohexyl-N-methylpropan-1-amine (CID 3028091) is 3-cyclohexyl-N-methylpropan-1-amine.
What is the SMILES notation for 3-cyclohexyl-N-methylpropan-1-amine?
The canonical SMILES for 3-cyclohexyl-N-methylpropan-1-amine is CNCCCC1CCCCC1.
What is the InChIKey of 3-cyclohexyl-N-methylpropan-1-amine?
The InChIKey is IILRAHSGEUAOTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-11-9-5-8-10-6-3-2-4-7-10/h10-11H,2-9H2,1H3.
What are the key properties of 3-cyclohexyl-N-methylpropan-1-amine?
3-cyclohexyl-N-methylpropan-1-amine has a molecular weight of 155.28 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-methylpropan-1-amine is sourced from PubChem (CID 3028091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).