2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine

C14H15ClN2 — CID 104735876

IUPAC2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine
SMILESCC(N)(Cc1cccnc1)c1cccc(Cl)c1
InChIInChI=1S/C14H15ClN2/c1-14(16,9-11-4-3-7-17-10-11)12-5-2-6-13(15)8-12/h2-8,10H,9,16H2,1H3
InChIKeyFILMHCMBIPWVBJ-UHFFFAOYSA-N
MW246.74 g/mol
LogP3.15
Rot. Bonds3

About 2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine

2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine (PubChem CID 104735876) has the molecular formula C14H15ClN2 and a molecular weight of 246.74 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine.

Molecular Properties

Compound Name2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine
PubChem CID104735876
Molecular FormulaC14H15ClN2
Molecular Weight246.74 g/mol
Exact Mass246.09
IUPAC Name2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine
SMILESCC(N)(Cc1cccnc1)c1cccc(Cl)c1
InChIInChI=1S/C14H15ClN2/c1-14(16,9-11-4-3-7-17-10-11)12-5-2-6-13(15)8-12/h2-8,10H,9,16H2,1H3
InChIKeyFILMHCMBIPWVBJ-UHFFFAOYSA-N
XLogP3.15
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.74
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-amine
CID 63408099
2-methyl-1-pyridin-3-ylpropan-2-amine;dihydrochloride
CID 131637820
2-(2,5-dichlorophenyl)-2-methyl-3-pyridin-3-ylpropan-1-amine
CID 117048430
2-(3-chlorophenyl)-1-(1-methylimidazol-2-yl)propan-2-amine
CID 79745086
2-(3-chlorophenyl)-5-phenylpentan-2-amine
CID 55095968
2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine
CID 114872773
2-(3-chlorophenyl)-2-methyl-3-phenyl-4-pyridin-3-ylbutanenitrile
CID 70448206
3-(2,2-dimethylpropyl)pyridine;methane
CID 160666805
2-(3-methylphenyl)-1-pyridin-3-ylpropan-2-ol
CID 104735632
1-(3-chlorophenyl)-1-pyrimidin-5-ylethanamine
CID 62490873
2-(3-aminophenyl)-2-methyl-3-pyridin-3-ylpropanoic acid
CID 117048325
1-[3-(2-amino-2-phenylpropyl)phenyl]-2-phenylpropan-2-amine
CID 175440072

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine?
The IUPAC name of 2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine (CID 104735876) is 2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine.
What is the SMILES notation for 2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine?
The canonical SMILES for 2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine is CC(N)(Cc1cccnc1)c1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine?
The InChIKey is FILMHCMBIPWVBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2/c1-14(16,9-11-4-3-7-17-10-11)12-5-2-6-13(15)8-12/h2-8,10H,9,16H2,1H3.
What are the key properties of 2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine?
2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine has a molecular weight of 246.74 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine is sourced from PubChem (CID 104735876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).