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

C16H25N — CID 65412175

IUPAC(2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine
SMILESCCC1CCC(C(N)c2ccc(C)cc2C)C1
InChIInChI=1S/C16H25N/c1-4-13-6-7-14(10-13)16(17)15-8-5-11(2)9-12(15)3/h5,8-9,13-14,16H,4,6-7,10,17H2,1-3H3
InChIKeySSFZDFDWZFUXJQ-UHFFFAOYSA-N
MW231.38 g/mol
LogP4.13
Rot. Bonds3

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

(2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine (PubChem CID 65412175) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is (2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine.

Molecular Properties

Compound Name(2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine
PubChem CID65412175
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC Name(2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine
SMILESCCC1CCC(C(N)c2ccc(C)cc2C)C1
InChIInChI=1S/C16H25N/c1-4-13-6-7-14(10-13)16(17)15-8-5-11(2)9-12(15)3/h5,8-9,13-14,16H,4,6-7,10,17H2,1-3H3
InChIKeySSFZDFDWZFUXJQ-UHFFFAOYSA-N
XLogP4.13
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2,4-dimethylphenyl)-(3-ethylcyclohexyl)methanamine
CID 65415138
(2,5-dimethylphenyl)-(3-ethylcyclopentyl)methanamine
CID 65410620
(3-ethylcyclopentyl)-(3-methylphenyl)methanamine
CID 65410214
(3-ethylcyclohexyl)-(2,4,5-trimethylphenyl)methanamine
CID 65415344
(R)-cyclobutyl-(2,4-dimethylphenyl)methanamine;hydrochloride
CID 171213154
2-(2,5-dimethylphenyl)-1-(3-ethylcyclopentyl)ethanamine
CID 65410217
(3-ethylcyclopentyl)-(2-fluoro-4,6-dimethylphenyl)methanamine
CID 106881656
4-[amino-(2,4-dimethylphenyl)methyl]-N-methylcyclohexan-1-amine
CID 116937234
(2,5-dimethoxyphenyl)-(3-ethylcyclopentyl)methanamine
CID 65411014
2-cyclopentyl-1-(2,4-dimethylphenyl)ethanamine
CID 43825536
(5-chloro-2-methylphenyl)-(4-ethylcyclohexyl)methanamine
CID 104990915
(3-ethylcyclopentyl)-(4-fluorophenyl)methanamine
CID 65410226

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine?
The IUPAC name of (2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine (CID 65412175) is (2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine.
What is the SMILES notation for (2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine?
The canonical SMILES for (2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine is CCC1CCC(C(N)c2ccc(C)cc2C)C1.
What is the InChIKey of (2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine?
The InChIKey is SSFZDFDWZFUXJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-4-13-6-7-14(10-13)16(17)15-8-5-11(2)9-12(15)3/h5,8-9,13-14,16H,4,6-7,10,17H2,1-3H3.
What are the key properties of (2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine?
(2,4-dimethylphenyl)-(3-ethylcyclopentyl)methanamine has a molecular weight of 231.38 g/mol, XLogP of 4.13, 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-ethylcyclopentyl)methanamine is sourced from PubChem (CID 65412175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).