3-cyclohexyl-N,2-dimethylbutan-1-amine

C12H25N — CID 81015775

IUPAC3-cyclohexyl-N,2-dimethylbutan-1-amine
SMILESCNCC(C)C(C)C1CCCCC1
InChIInChI=1S/C12H25N/c1-10(9-13-3)11(2)12-7-5-4-6-8-12/h10-13H,4-9H2,1-3H3
InChIKeyLJLZYLMKTGBLGN-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.06
Rot. Bonds4

About 3-cyclohexyl-N,2-dimethylbutan-1-amine

3-cyclohexyl-N,2-dimethylbutan-1-amine (PubChem CID 81015775) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 3-cyclohexyl-N,2-dimethylbutan-1-amine.

Molecular Properties

Compound Name3-cyclohexyl-N,2-dimethylbutan-1-amine
PubChem CID81015775
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name3-cyclohexyl-N,2-dimethylbutan-1-amine
SMILESCNCC(C)C(C)C1CCCCC1
InChIInChI=1S/C12H25N/c1-10(9-13-3)11(2)12-7-5-4-6-8-12/h10-13H,4-9H2,1-3H3
InChIKeyLJLZYLMKTGBLGN-UHFFFAOYSA-N
XLogP3.06
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(4-ethylcyclohexyl)-N,2-dimethylbutan-1-amine
CID 81015890
2-cycloheptyl-N-methylpropan-1-amine
CID 82931674
3-cyclohexyl-2-methyl-N-(2-methylpropyl)butan-1-amine
CID 81015222
[(3R)-3-methylpentan-2-yl]cyclopentane
CID 144516432
3-N-cycloheptyl-1-N,3-N,2-trimethylbutane-1,3-diamine
CID 79408924
2-cycloheptyl-N-methylpentan-1-amine
CID 82932063
3-cyclopentyl-N,2-dimethylpropan-1-amine
CID 62530877
N-[(1S)-1-cyclohexylethyl]-2-methyl-3-(methylamino)propanamide
CID 81385876
N-[2-methyl-3-(4-methylcyclohexyl)butyl]cyclopropanamine
CID 81015091
N-cyclohexyl-2-methyl-3-(methylamino)propanamide
CID 79195893
2-methyl-3-(oxan-4-yl)-N-propan-2-ylbutan-1-amine
CID 81016369
[(2R)-3-methylhexan-2-yl]cyclopentane
CID 163746154

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N,2-dimethylbutan-1-amine?
The IUPAC name of 3-cyclohexyl-N,2-dimethylbutan-1-amine (CID 81015775) is 3-cyclohexyl-N,2-dimethylbutan-1-amine.
What is the SMILES notation for 3-cyclohexyl-N,2-dimethylbutan-1-amine?
The canonical SMILES for 3-cyclohexyl-N,2-dimethylbutan-1-amine is CNCC(C)C(C)C1CCCCC1.
What is the InChIKey of 3-cyclohexyl-N,2-dimethylbutan-1-amine?
The InChIKey is LJLZYLMKTGBLGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-10(9-13-3)11(2)12-7-5-4-6-8-12/h10-13H,4-9H2,1-3H3.
What are the key properties of 3-cyclohexyl-N,2-dimethylbutan-1-amine?
3-cyclohexyl-N,2-dimethylbutan-1-amine has a molecular weight of 183.34 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N,2-dimethylbutan-1-amine is sourced from PubChem (CID 81015775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).