2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine

C18H22N2 — CID 117049092

IUPAC2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine
SMILESCC(CN)(Cc1ccncc1)c1ccc(C2CC2)cc1
InChIInChI=1S/C18H22N2/c1-18(13-19,12-14-8-10-20-11-9-14)17-6-4-16(5-7-17)15-2-3-15/h4-11,15H,2-3,12-13,19H2,1H3
InChIKeyCCHKNMWMUXJLQE-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.42
Rot. Bonds5

About 2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine

2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine (PubChem CID 117049092) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine.

Molecular Properties

Compound Name2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine
PubChem CID117049092
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine
SMILESCC(CN)(Cc1ccncc1)c1ccc(C2CC2)cc1
InChIInChI=1S/C18H22N2/c1-18(13-19,12-14-8-10-20-11-9-14)17-6-4-16(5-7-17)15-2-3-15/h4-11,15H,2-3,12-13,19H2,1H3
InChIKeyCCHKNMWMUXJLQE-UHFFFAOYSA-N
XLogP3.42
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-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-(4-cyclopropylphenyl)-2-methyl-3-thiophen-2-ylpropan-1-amine
CID 117048882
2-(3,4-difluorophenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine
CID 117049073
2-(3,5-dichlorophenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine
CID 117049081
1-amino-2-(4-cyclobutylphenyl)propan-2-ol
CID 116505464
(3-pyridin-4-ylcyclopentyl)methanamine
CID 82280551
4-(2,2-dimethylpropyl)pyridine
CID 22960904
4-(4-butylcyclohexyl)pyridine;ethane
CID 143311003
2-methyl-1-pyridin-4-ylpropan-2-amine;hydrochloride
CID 141017506
3-pyridin-4-yl-2-(pyridin-4-ylmethyl)propane-1,2-diamine
CID 175283215
1-(4-cyclopropylphenyl)ethane-1,1-diol
CID 91219710
2-[4-(4-methylcyclohexyl)phenyl]propan-2-amine
CID 117335176
2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-3-ylpropanoic acid
CID 117048309

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine?
The IUPAC name of 2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine (CID 117049092) is 2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine.
What is the SMILES notation for 2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine?
The canonical SMILES for 2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine is CC(CN)(Cc1ccncc1)c1ccc(C2CC2)cc1.
What is the InChIKey of 2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine?
The InChIKey is CCHKNMWMUXJLQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-18(13-19,12-14-8-10-20-11-9-14)17-6-4-16(5-7-17)15-2-3-15/h4-11,15H,2-3,12-13,19H2,1H3.
What are the key properties of 2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine?
2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine has a molecular weight of 266.39 g/mol, XLogP of 3.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropylphenyl)-2-methyl-3-pyridin-4-ylpropan-1-amine is sourced from PubChem (CID 117049092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).