1-(4-cyclohexylphenyl)-N-methylpropan-2-amine

C16H25N — CID 82262296

IUPAC1-(4-cyclohexylphenyl)-N-methylpropan-2-amine
SMILESCNC(C)Cc1ccc(C2CCCCC2)cc1
InChIInChI=1S/C16H25N/c1-13(17-2)12-14-8-10-16(11-9-14)15-6-4-3-5-7-15/h8-11,13,15,17H,3-7,12H2,1-2H3
InChIKeyGDJREXJXZCLXTB-UHFFFAOYSA-N
MW231.38 g/mol
LogP3.88
Rot. Bonds4

About 1-(4-cyclohexylphenyl)-N-methylpropan-2-amine

1-(4-cyclohexylphenyl)-N-methylpropan-2-amine (PubChem CID 82262296) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is 1-(4-cyclohexylphenyl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-(4-cyclohexylphenyl)-N-methylpropan-2-amine
PubChem CID82262296
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC Name1-(4-cyclohexylphenyl)-N-methylpropan-2-amine
SMILESCNC(C)Cc1ccc(C2CCCCC2)cc1
InChIInChI=1S/C16H25N/c1-13(17-2)12-14-8-10-16(11-9-14)15-6-4-3-5-7-15/h8-11,13,15,17H,3-7,12H2,1-2H3
InChIKeyGDJREXJXZCLXTB-UHFFFAOYSA-N
XLogP3.88
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-cyclohexylphenyl)-1-(methylamino)ethanol
CID 175264213
1-(2-chloropropyl)-4-cyclohexylbenzene
CID 82255538
3-(4-cyclohexylphenyl)-2-methylpropan-1-amine
CID 116924713
1-(4-cyclohexylphenyl)-N-methylethanamine
CID 43484988
4-(4-cyclohexylphenyl)-3-methylbutanoic acid
CID 116926748
1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine
CID 116954314
1-(4-cyclohexylphenyl)-N,3-dimethylbutan-1-amine
CID 43484998
N-[(4-cyclopropylphenyl)methyl]propan-2-amine
CID 62491335
1-[1-(4-cyclohexylphenyl)propan-2-yl]piperazine
CID 82255626
1-(4-cyclopropylphenyl)propan-2-amine
CID 79983899
1-(4-cyclohexylphenyl)-N'-methylmethanediamine
CID 116939287
methyl 2-(4-cycloheptylphenyl)acetate
CID 54417181

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclohexylphenyl)-N-methylpropan-2-amine?
The IUPAC name of 1-(4-cyclohexylphenyl)-N-methylpropan-2-amine (CID 82262296) is 1-(4-cyclohexylphenyl)-N-methylpropan-2-amine.
What is the SMILES notation for 1-(4-cyclohexylphenyl)-N-methylpropan-2-amine?
The canonical SMILES for 1-(4-cyclohexylphenyl)-N-methylpropan-2-amine is CNC(C)Cc1ccc(C2CCCCC2)cc1.
What is the InChIKey of 1-(4-cyclohexylphenyl)-N-methylpropan-2-amine?
The InChIKey is GDJREXJXZCLXTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-13(17-2)12-14-8-10-16(11-9-14)15-6-4-3-5-7-15/h8-11,13,15,17H,3-7,12H2,1-2H3.
What are the key properties of 1-(4-cyclohexylphenyl)-N-methylpropan-2-amine?
1-(4-cyclohexylphenyl)-N-methylpropan-2-amine has a molecular weight of 231.38 g/mol, XLogP of 3.88, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclohexylphenyl)-N-methylpropan-2-amine is sourced from PubChem (CID 82262296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).