2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine

C16H23N — CID 84692984

IUPAC2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine
SMILESCc1cccc(C2(N)CC2C2CCCCC2)c1
InChIInChI=1S/C16H23N/c1-12-6-5-9-14(10-12)16(17)11-15(16)13-7-3-2-4-8-13/h5-6,9-10,13,15H,2-4,7-8,11,17H2,1H3
InChIKeyXCVKVUSYNJNTNA-UHFFFAOYSA-N
MW229.37 g/mol
LogP3.75
Rot. Bonds2

About 2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine

2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine (PubChem CID 84692984) has the molecular formula C16H23N and a molecular weight of 229.37 g/mol. Its IUPAC name is 2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine.

Molecular Properties

Compound Name2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine
PubChem CID84692984
Molecular FormulaC16H23N
Molecular Weight229.37 g/mol
Exact Mass229.18
IUPAC Name2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine
SMILESCc1cccc(C2(N)CC2C2CCCCC2)c1
InChIInChI=1S/C16H23N/c1-12-6-5-9-14(10-12)16(17)11-15(16)13-7-3-2-4-8-13/h5-6,9-10,13,15H,2-4,7-8,11,17H2,1H3
InChIKeyXCVKVUSYNJNTNA-UHFFFAOYSA-N
XLogP3.75
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(3-methylphenyl)bicyclo[3.1.0]hexan-3-amine
CID 82405285
1-(3-chlorophenyl)-2-cyclohexylcyclohexan-1-amine
CID 63408511
1-(3-methylphenyl)cyclopentan-1-amine
CID 43345653
(1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine
CID 105453912
2-cyclohexyl-1-(3-fluoro-5-methylphenyl)cyclohexan-1-amine
CID 79696981
3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine
CID 64751059
1-methyl-3-[1-(3-methylphenyl)cyclohexyl]benzene
CID 19798314
(1S,2S,5S)-5-(3-methylphenyl)bicyclo[3.1.0]hexan-2-ol
CID 129364913
[2-cyclopentyl-2-(3-methylphenyl)cyclopropyl]methanol
CID 105488570
1-(3-methylphenyl)-3-propylcyclobutan-1-amine
CID 65013464
2-methyl-1-(3-methylphenyl)cyclopropan-1-ol
CID 79332542
methylcyclopentane;1,3-xylene
CID 142361462

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine?
The IUPAC name of 2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine (CID 84692984) is 2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine.
What is the SMILES notation for 2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine?
The canonical SMILES for 2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine is Cc1cccc(C2(N)CC2C2CCCCC2)c1.
What is the InChIKey of 2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine?
The InChIKey is XCVKVUSYNJNTNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N/c1-12-6-5-9-14(10-12)16(17)11-15(16)13-7-3-2-4-8-13/h5-6,9-10,13,15H,2-4,7-8,11,17H2,1H3.
What are the key properties of 2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine?
2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine has a molecular weight of 229.37 g/mol, XLogP of 3.75, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(3-methylphenyl)cyclopropan-1-amine is sourced from PubChem (CID 84692984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).