4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide

C20H14N6O2 — CID 155481800

IUPAC4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide
SMILESN#Cc1cnc(C(=O)Nc2ccc3[nH]nc(-c4cnco4)c3c2)c2c1CCC2
InChIInChI=1S/C20H14N6O2/c21-7-11-8-23-19(14-3-1-2-13(11)14)20(27)24-12-4-5-16-15(6-12)18(26-25-16)17-9-22-10-28-17/h4-6,8-10H,1-3H2,(H,24,27)(H,25,26)
InChIKeyNOGMVNNAARFCEP-UHFFFAOYSA-N
MW370.37 g/mol
LogP3.23
Rot. Bonds3

About 4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide

4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide (PubChem CID 155481800) has the molecular formula C20H14N6O2 and a molecular weight of 370.37 g/mol. Its IUPAC name is 4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide.

Molecular Properties

Compound Name4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide
PubChem CID155481800
Molecular FormulaC20H14N6O2
Molecular Weight370.37 g/mol
Exact Mass370.12
IUPAC Name4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide
SMILESN#Cc1cnc(C(=O)Nc2ccc3[nH]nc(-c4cnco4)c3c2)c2c1CCC2
InChIInChI=1S/C20H14N6O2/c21-7-11-8-23-19(14-3-1-2-13(11)14)20(27)24-12-4-5-16-15(6-12)18(26-25-16)17-9-22-10-28-17/h4-6,8-10H,1-3H2,(H,24,27)(H,25,26)
InChIKeyNOGMVNNAARFCEP-UHFFFAOYSA-N
XLogP3.23
TPSA120.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.37
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide?
The IUPAC name of 4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide (CID 155481800) is 4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide.
What is the SMILES notation for 4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide?
The canonical SMILES for 4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide is N#Cc1cnc(C(=O)Nc2ccc3[nH]nc(-c4cnco4)c3c2)c2c1CCC2.
What is the InChIKey of 4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide?
The InChIKey is NOGMVNNAARFCEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N6O2/c21-7-11-8-23-19(14-3-1-2-13(11)14)20(27)24-12-4-5-16-15(6-12)18(26-25-16)17-9-22-10-28-17/h4-6,8-10H,1-3H2,(H,24,27)(H,25,26).
What are the key properties of 4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide?
4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide has a molecular weight of 370.37 g/mol, XLogP of 3.23, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyano-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide is sourced from PubChem (CID 155481800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).