N-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine

C23H18FN3S — CID 146048309

IUPACN-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine
SMILESFc1ccc(Nc2nc(-c3ccccn3)c3c(c2-c2cccs2)CCC3)cc1
InChIInChI=1S/C23H18FN3S/c24-15-9-11-16(12-10-15)26-23-21(20-8-4-14-28-20)17-5-3-6-18(17)22(27-23)19-7-1-2-13-25-19/h1-2,4,7-14H,3,5-6H2,(H,26,27)
InChIKeyPGOCNRMVUDDBEL-UHFFFAOYSA-N
MW387.48 g/mol
LogP6.24
Rot. Bonds4

About N-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine

N-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine (PubChem CID 146048309) has the molecular formula C23H18FN3S and a molecular weight of 387.48 g/mol. Its IUPAC name is N-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine.

Molecular Properties

Compound NameN-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine
PubChem CID146048309
Molecular FormulaC23H18FN3S
Molecular Weight387.48 g/mol
Exact Mass387.12
IUPAC NameN-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine
SMILESFc1ccc(Nc2nc(-c3ccccn3)c3c(c2-c2cccs2)CCC3)cc1
InChIInChI=1S/C23H18FN3S/c24-15-9-11-16(12-10-15)26-23-21(20-8-4-14-28-20)17-5-3-6-18(17)22(27-23)19-7-1-2-13-25-19/h1-2,4,7-14H,3,5-6H2,(H,26,27)
InChIKeyPGOCNRMVUDDBEL-UHFFFAOYSA-N
XLogP6.24
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.48
LogP ≤ 56.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(Piperazin-1-yl)thieno[3,2-c]pyridine
CID 10966027
3-(4-Aminophenyl)thieno(3,2-c)pyridin-4-amine
CID 18450753
1-Pyridin-2-yl-4-[2-(4-thiophen-2-yl-cyclohex-3-enyl)-ethyl]-piperazine
CID 15079637
N-[4-(4-ethylpiperazin-1-yl)phenyl]-7-phenylthieno[3,2-d]pyrimidin-2-amine
CID 164609501
N-[4-(4-ethylpiperazin-1-yl)phenyl]-7-pyridin-2-ylthieno[3,2-d]pyrimidin-2-amine
CID 164616904
N-[4-(4-ethylpiperazin-1-yl)phenyl]-7-pyridin-3-ylthieno[3,2-d]pyrimidin-2-amine
CID 164624174
N-(pyridin-2-ylmethyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-amine
CID 944383
2-Amino-6-pyridin-2-yl-4-thiophen-2-ylpyridine-3-carbonitrile
CID 665499
N-benzyl-6-methyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine
CID 808829
N1-(7-(thiophen-2-yl)-1,6-naphthyridin-5-yl)propane-1,3-diamine
CID 10286183
2-[[1-[4,4-Bis(4-fluorophenyl)butyl]piperidin-4-yl]methyl]-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine
CID 14013470
1-(3-(4-Aminothieno[3,2-c]pyridin-3-yl)phenyl)-3-m-tolylurea
CID 18450928

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine?
The IUPAC name of N-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine (CID 146048309) is N-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine.
What is the SMILES notation for N-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine?
The canonical SMILES for N-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine is Fc1ccc(Nc2nc(-c3ccccn3)c3c(c2-c2cccs2)CCC3)cc1.
What is the InChIKey of N-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine?
The InChIKey is PGOCNRMVUDDBEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18FN3S/c24-15-9-11-16(12-10-15)26-23-21(20-8-4-14-28-20)17-5-3-6-18(17)22(27-23)19-7-1-2-13-25-19/h1-2,4,7-14H,3,5-6H2,(H,26,27).
What are the key properties of N-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine?
N-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine has a molecular weight of 387.48 g/mol, XLogP of 6.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-1-pyridin-2-yl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine is sourced from PubChem (CID 146048309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).