(4-cyclohexylphenyl)methanamine

C13H19N — CID 22246867

IUPAC(4-cyclohexylphenyl)methanamine
SMILESNCc1ccc(C2CCCCC2)cc1
InChIInChI=1S/C13H19N/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h6-9,12H,1-5,10,14H2
InChIKeyHOTDNAGZXRCBOK-UHFFFAOYSA-N
MW189.30 g/mol
LogP3.19
Rot. Bonds2

About (4-cyclohexylphenyl)methanamine

(4-cyclohexylphenyl)methanamine (PubChem CID 22246867) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is (4-cyclohexylphenyl)methanamine.

Molecular Properties

Compound Name(4-cyclohexylphenyl)methanamine
PubChem CID22246867
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name(4-cyclohexylphenyl)methanamine
SMILESNCc1ccc(C2CCCCC2)cc1
InChIInChI=1S/C13H19N/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h6-9,12H,1-5,10,14H2
InChIKeyHOTDNAGZXRCBOK-UHFFFAOYSA-N
XLogP3.19
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[4-(1-methylazepan-4-yl)phenyl]methanamine
CID 83836852
4-(4-cyclopentylphenyl)butan-1-amine
CID 117310056
3-(4-cyclohexylphenyl)-2-methylpropan-1-amine
CID 116924713
(4-cyclohexylphenyl)-dideuteriomethanol
CID 162410552
[4-(4-piperidin-4-ylphenyl)phenyl]methanamine
CID 116988072
5-(4-cyclohexylphenyl)-3,3-dimethylpentan-1-amine
CID 65300733
1-cyclohexyl-4-(methylsulfanylmethyl)benzene
CID 59166778
[5-(4-cyclohexylphenyl)-1,3,4-thiadiazol-2-yl]methanamine
CID 82360101
N-[(4-cyclopentylphenyl)methyl]hydroxylamine
CID 117282542
1-(4-cyclohexylphenyl)ethane-1,2-diamine
CID 77131240
[4-(oxolan-3-yl)phenyl]methanamine
CID 83827764
(1R)-1-(4-cyclohexylphenyl)ethane-1,2-diamine
CID 66517695

Frequently Asked Questions

What is the IUPAC name of (4-cyclohexylphenyl)methanamine?
The IUPAC name of (4-cyclohexylphenyl)methanamine (CID 22246867) is (4-cyclohexylphenyl)methanamine.
What is the SMILES notation for (4-cyclohexylphenyl)methanamine?
The canonical SMILES for (4-cyclohexylphenyl)methanamine is NCc1ccc(C2CCCCC2)cc1.
What is the InChIKey of (4-cyclohexylphenyl)methanamine?
The InChIKey is HOTDNAGZXRCBOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h6-9,12H,1-5,10,14H2.
What are the key properties of (4-cyclohexylphenyl)methanamine?
(4-cyclohexylphenyl)methanamine has a molecular weight of 189.30 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclohexylphenyl)methanamine is sourced from PubChem (CID 22246867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).