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

C20H16ClFN2 — CID 90338524

IUPAC2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine
SMILESFc1ccc(Nc2cc(-c3cccc(Cl)c3)nc3c2CCC3)cc1
InChIInChI=1S/C20H16ClFN2/c21-14-4-1-3-13(11-14)19-12-20(17-5-2-6-18(17)24-19)23-16-9-7-15(22)8-10-16/h1,3-4,7-12H,2,5-6H2,(H,23,24)
InChIKeyJHICYRVCGPQYGI-UHFFFAOYSA-N
MW338.81 g/mol
LogP5.77
Rot. Bonds3

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

2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine (PubChem CID 90338524) has the molecular formula C20H16ClFN2 and a molecular weight of 338.81 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine
PubChem CID90338524
Molecular FormulaC20H16ClFN2
Molecular Weight338.81 g/mol
Exact Mass338.10
IUPAC Name2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine
SMILESFc1ccc(Nc2cc(-c3cccc(Cl)c3)nc3c2CCC3)cc1
InChIInChI=1S/C20H16ClFN2/c21-14-4-1-3-13(11-14)19-12-20(17-5-2-6-18(17)24-19)23-16-9-7-15(22)8-10-16/h1,3-4,7-12H,2,5-6H2,(H,23,24)
InChIKeyJHICYRVCGPQYGI-UHFFFAOYSA-N
XLogP5.77
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.81
LogP ≤ 55.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-chlorophenyl)-N-(4-fluorophenyl)-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

N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 4187113
2-(4-((2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl)amino)phenyl)acetamide
CID 74220906
2-[4-[[2-(3-Chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]amino]phenyl]ethanol
CID 74220907
3-[4-[[2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]amino]phenyl]propanamide
CID 90110531
2-[4-[[2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]amino]phenyl]-N,N-dimethylacetamide
CID 90338526
2-[3-[[2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]amino]phenyl]ethanol
CID 90338537
2-[4-[[2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]-methylamino]phenyl]acetamide
CID 118037253
2-[4-[[2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]amino]phenyl]-N-methylacetamide
CID 118037440
7-chloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine;hydrochloride
CID 164610888
2-(3-Chloro-4-fluorophenyl)indole
CID 2736577
7-chloro-N-(2,5-difluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 16009527
N-[[6-(3-chloro-4-fluorophenyl)-2-pyridinyl]methyl]-N',N'-dimethylpropane-1,3-diamine
CID 137654134

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine?
The IUPAC name of 2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine (CID 90338524) is 2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine.
What is the SMILES notation for 2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine?
The canonical SMILES for 2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine is Fc1ccc(Nc2cc(-c3cccc(Cl)c3)nc3c2CCC3)cc1.
What is the InChIKey of 2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine?
The InChIKey is JHICYRVCGPQYGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClFN2/c21-14-4-1-3-13(11-14)19-12-20(17-5-2-6-18(17)24-19)23-16-9-7-15(22)8-10-16/h1,3-4,7-12H,2,5-6H2,(H,23,24).
What are the key properties of 2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine?
2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine has a molecular weight of 338.81 g/mol, XLogP of 5.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine is sourced from PubChem (CID 90338524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).