3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine

C14H21N — CID 82076833

IUPAC3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine
SMILESCc1ccc(C(CCN)C2CC2)c(C)c1
InChIInChI=1S/C14H21N/c1-10-3-6-13(11(2)9-10)14(7-8-15)12-4-5-12/h3,6,9,12,14H,4-5,7-8,15H2,1-2H3
InChIKeyYEDJVZYEQDTLMD-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.15
Rot. Bonds4

About 3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine

3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine (PubChem CID 82076833) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine.

Molecular Properties

Compound Name3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine
PubChem CID82076833
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine
SMILESCc1ccc(C(CCN)C2CC2)c(C)c1
InChIInChI=1S/C14H21N/c1-10-3-6-13(11(2)9-10)14(7-8-15)12-4-5-12/h3,6,9,12,14H,4-5,7-8,15H2,1-2H3
InChIKeyYEDJVZYEQDTLMD-UHFFFAOYSA-N
XLogP3.15
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2,4-dimethylphenyl)-2-(1-propylpiperidin-4-yl)ethanamine
CID 83972813
(1R)-3-amino-1-(2,4-dimethylphenyl)propan-1-ol
CID 93182212
3-cyclohexyl-3-(2,4-dimethylphenyl)propanamide
CID 82089979
(1S,5R)-1,5-di(cyclobutyl)-1,5-bis(2,4-dimethylphenyl)pentan-3-one
CID 97304157
3-cyclopentyl-3-(4-methylphenyl)propan-1-amine
CID 82079151
(1R,5R)-1,5-dicyclohexyl-1,5-bis(2,4-dimethylphenyl)pentan-3-one
CID 97304203
N-(1-cyclopropylethyl)-1-(2,4-dimethylphenyl)-N-methylethane-1,2-diamine
CID 43568902
2-(4-chloro-2-methylphenyl)-2-cyclopentylethanamine
CID 83824559
3-cyclopropyl-3-(4-ethoxy-3-methylphenyl)propan-1-amine
CID 112512208
2-(2,4-dimethylphenyl)-2-piperidin-2-ylethanamine
CID 83986431
2-cyclopentyl-1-(2,4-dimethylphenyl)ethanamine
CID 43825536
3-cyclopentyl-3-(2,4-dimethylphenyl)-N-methylpropanamide
CID 82089980

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine?
The IUPAC name of 3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine (CID 82076833) is 3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine.
What is the SMILES notation for 3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine?
The canonical SMILES for 3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine is Cc1ccc(C(CCN)C2CC2)c(C)c1.
What is the InChIKey of 3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine?
The InChIKey is YEDJVZYEQDTLMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-10-3-6-13(11(2)9-10)14(7-8-15)12-4-5-12/h3,6,9,12,14H,4-5,7-8,15H2,1-2H3.
What are the key properties of 3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine?
3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-3-(2,4-dimethylphenyl)propan-1-amine is sourced from PubChem (CID 82076833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).