(2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine

C17H27N — CID 65415138

IUPAC(2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine
SMILESCCC1CCCC(C(N)c2ccc(C)cc2C)C1
InChIInChI=1S/C17H27N/c1-4-14-6-5-7-15(11-14)17(18)16-9-8-12(2)10-13(16)3/h8-10,14-15,17H,4-7,11,18H2,1-3H3
InChIKeyODDHXPLOIKFULP-UHFFFAOYSA-N
MW245.41 g/mol
LogP4.52
Rot. Bonds3

About (2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine

(2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine (PubChem CID 65415138) has the molecular formula C17H27N and a molecular weight of 245.41 g/mol. Its IUPAC name is (2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine.

Molecular Properties

Compound Name(2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine
PubChem CID65415138
Molecular FormulaC17H27N
Molecular Weight245.41 g/mol
Exact Mass245.21
IUPAC Name(2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine
SMILESCCC1CCCC(C(N)c2ccc(C)cc2C)C1
InChIInChI=1S/C17H27N/c1-4-14-6-5-7-15(11-14)17(18)16-9-8-12(2)10-13(16)3/h8-10,14-15,17H,4-7,11,18H2,1-3H3
InChIKeyODDHXPLOIKFULP-UHFFFAOYSA-N
XLogP4.52
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine
CID 65412175
(3-ethylcyclohexyl)-(2,4,5-trimethylphenyl)methanamine
CID 65415344
(R)-cyclobutyl-(2,4-dimethylphenyl)methanamine;hydrochloride
CID 171213154
(2,5-dimethylphenyl)-(3-ethylcyclopentyl)methanamine
CID 65410620
(2,4-dichlorophenyl)-(3-ethylcyclohexyl)methanamine
CID 104992313
2-cyclopentyl-1-(2,4-dimethylphenyl)ethanamine
CID 43825536
(2,4-dimethoxyphenyl)-(3-ethylcyclohexyl)methanamine
CID 65414537
(3-ethylcyclohexyl)-(3-methylfuran-2-yl)methanamine
CID 104804511
4-[amino-(2,4-dimethylphenyl)methyl]-N-methylcyclohexan-1-amine
CID 116937234
(2,4-dimethylphenyl)-piperidin-3-ylmethanamine
CID 116935781
(4-bromo-2-methylphenyl)-(3-ethylcyclohexyl)methanol
CID 115808444
(3-ethylcyclohexyl)-(5-fluoro-2-methoxyphenyl)methanamine
CID 82770138

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine?
The IUPAC name of (2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine (CID 65415138) is (2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine.
What is the SMILES notation for (2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine?
The canonical SMILES for (2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine is CCC1CCCC(C(N)c2ccc(C)cc2C)C1.
What is the InChIKey of (2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine?
The InChIKey is ODDHXPLOIKFULP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N/c1-4-14-6-5-7-15(11-14)17(18)16-9-8-12(2)10-13(16)3/h8-10,14-15,17H,4-7,11,18H2,1-3H3.
What are the key properties of (2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine?
(2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine has a molecular weight of 245.41 g/mol, XLogP of 4.52, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine is sourced from PubChem (CID 65415138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).