3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine

C14H12Cl2N2 — CID 90338520

IUPAC3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine
SMILESNc1c(Cl)c(-c2cccc(Cl)c2)nc2c1CCC2
InChIInChI=1S/C14H12Cl2N2/c15-9-4-1-3-8(7-9)14-12(16)13(17)10-5-2-6-11(10)18-14/h1,3-4,7H,2,5-6H2,(H2,17,18)
InChIKeyROXAAYYVFJKZBQ-UHFFFAOYSA-N
MW279.17 g/mol
LogP4.13
Rot. Bonds1

About 3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine

3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine (PubChem CID 90338520) has the molecular formula C14H12Cl2N2 and a molecular weight of 279.17 g/mol. Its IUPAC name is 3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine.

Molecular Properties

Compound Name3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine
PubChem CID90338520
Molecular FormulaC14H12Cl2N2
Molecular Weight279.17 g/mol
Exact Mass278.04
IUPAC Name3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine
SMILESNc1c(Cl)c(-c2cccc(Cl)c2)nc2c1CCC2
InChIInChI=1S/C14H12Cl2N2/c15-9-4-1-3-8(7-9)14-12(16)13(17)10-5-2-6-11(10)18-14/h1,3-4,7H,2,5-6H2,(H2,17,18)
InChIKeyROXAAYYVFJKZBQ-UHFFFAOYSA-N
XLogP4.13
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.17
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-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

4-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 90110675
4-(3-chlorophenyl)-2-(1-methylcyclopentyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine
CID 154465607
3-ethyl-2-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine
CID 146618854
2-(3-chlorophenyl)-N-cyclopentyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 15886985
5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 62202722
2-(3-chlorophenyl)-4-(2-methylsulfonylethylsulfanyl)-5,6,7,8-tetrahydroquinazoline
CID 133349219
3-amino-2-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridine-4-carboxylic acid
CID 82381467
3-(3-chlorophenyl)-5-methyl-1H-pyrazol-4-amine
CID 46167948
2-(3-chlorophenyl)-N-ethyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 63486503
2-[(3-chlorophenyl)methyl]-5,6,7,8-tetrahydroquinazolin-4-amine
CID 62192630
6-phenyl-1,2,3,4-tetrahydroacridin-9-amine
CID 19804321
4-chloro-2-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 118037090

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine?
The IUPAC name of 3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine (CID 90338520) is 3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine.
What is the SMILES notation for 3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine?
The canonical SMILES for 3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine is Nc1c(Cl)c(-c2cccc(Cl)c2)nc2c1CCC2.
What is the InChIKey of 3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine?
The InChIKey is ROXAAYYVFJKZBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2/c15-9-4-1-3-8(7-9)14-12(16)13(17)10-5-2-6-11(10)18-14/h1,3-4,7H,2,5-6H2,(H2,17,18).
What are the key properties of 3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine?
3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine has a molecular weight of 279.17 g/mol, XLogP of 4.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine is sourced from PubChem (CID 90338520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).