1-cyclohexyl-N-methylbutan-2-amine

C11H23N — CID 62601734

IUPAC1-cyclohexyl-N-methylbutan-2-amine
SMILESCCC(CC1CCCCC1)NC
InChIInChI=1S/C11H23N/c1-3-11(12-2)9-10-7-5-4-6-8-10/h10-12H,3-9H2,1-2H3
InChIKeyYQHZNIAXQRZQIR-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.95
Rot. Bonds4

About 1-cyclohexyl-N-methylbutan-2-amine

1-cyclohexyl-N-methylbutan-2-amine (PubChem CID 62601734) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 1-cyclohexyl-N-methylbutan-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-N-methylbutan-2-amine
PubChem CID62601734
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name1-cyclohexyl-N-methylbutan-2-amine
SMILESCCC(CC1CCCCC1)NC
InChIInChI=1S/C11H23N/c1-3-11(12-2)9-10-7-5-4-6-8-10/h10-12H,3-9H2,1-2H3
InChIKeyYQHZNIAXQRZQIR-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cycloheptyl-N-methylhexan-2-amine
CID 115832695
(2R)-3-cyclohexyl-1-N,1-N,2-N-trimethylpropane-1,2-diamine
CID 58597797
1-cyclohexyl-N-methylheptan-2-amine
CID 115836969
1-cyclopentyl-N-methyl-3-(thian-4-yl)propan-2-amine
CID 105138955
1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine
CID 105135620
1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine
CID 104986481
1-cyclohexyl-3-(4-ethylphenyl)-N-methylpropan-2-amine
CID 115802880
1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine
CID 62603326
1-cyclohexyl-N-methyl-3-(oxolan-3-yl)propan-2-amine
CID 103987113
1,3-dicyclopentyl-N-ethylpropan-2-amine
CID 115847226
2-cyclohexyl-1-cyclopropyl-N-methylethanamine
CID 62600401
1-cycloheptyl-N,6,6-trimethylheptan-2-amine
CID 114211051

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-methylbutan-2-amine?
The IUPAC name of 1-cyclohexyl-N-methylbutan-2-amine (CID 62601734) is 1-cyclohexyl-N-methylbutan-2-amine.
What is the SMILES notation for 1-cyclohexyl-N-methylbutan-2-amine?
The canonical SMILES for 1-cyclohexyl-N-methylbutan-2-amine is CCC(CC1CCCCC1)NC.
What is the InChIKey of 1-cyclohexyl-N-methylbutan-2-amine?
The InChIKey is YQHZNIAXQRZQIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-3-11(12-2)9-10-7-5-4-6-8-10/h10-12H,3-9H2,1-2H3.
What are the key properties of 1-cyclohexyl-N-methylbutan-2-amine?
1-cyclohexyl-N-methylbutan-2-amine has a molecular weight of 169.31 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-methylbutan-2-amine is sourced from PubChem (CID 62601734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).