2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide

C13H14N6O2 — CID 107346606

IUPAC2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
SMILESNC(=O)c1cc2c(nc1-n1cc(N)c(C(N)=O)n1)CCC2
InChIInChI=1S/C13H14N6O2/c14-8-5-19(18-10(8)12(16)21)13-7(11(15)20)4-6-2-1-3-9(6)17-13/h4-5H,1-3,14H2,(H2,15,20)(H2,16,21)
InChIKeyMTGPGAPMGXRBTC-UHFFFAOYSA-N
MW286.30 g/mol
LogP-0.46
Rot. Bonds3

About 2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide

2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide (PubChem CID 107346606) has the molecular formula C13H14N6O2 and a molecular weight of 286.30 g/mol. Its IUPAC name is 2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
PubChem CID107346606
Molecular FormulaC13H14N6O2
Molecular Weight286.30 g/mol
Exact Mass286.12
IUPAC Name2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
SMILESNC(=O)c1cc2c(nc1-n1cc(N)c(C(N)=O)n1)CCC2
InChIInChI=1S/C13H14N6O2/c14-8-5-19(18-10(8)12(16)21)13-7(11(15)20)4-6-2-1-3-9(6)17-13/h4-5H,1-3,14H2,(H2,15,20)(H2,16,21)
InChIKeyMTGPGAPMGXRBTC-UHFFFAOYSA-N
XLogP-0.46
TPSA142.91 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.30
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 83568678
1-(3-carbamothioyl-5,6,7,8-tetrahydroquinolin-2-yl)pyrazole-4-carboxamide
CID 64782537
2-(2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)-5,6,7,8-tetrahydroquinoline-3-carboxamide
CID 66212034
2-[(3R)-3-hydroxy-3-(hydroxymethyl)piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 95885523
2-[(3S)-3-hydroxy-3-(hydroxymethyl)piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 95885525
2-[3-(trifluoromethyl)pyrazol-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxylic acid
CID 62702724
2-(1,3-dioxo-2,7-diazaspiro[4.4]nonan-7-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 70715684
2-[(5S)-7-methyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 95881220
4-(4-amino-3-carbamoylpyrazol-1-yl)-2,6-dimethylpyridine-3-carboxamide
CID 107346578
2-[4-hydroxy-4-(methoxymethyl)-3,3-dimethylpiperidin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 156603375
2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 39818675
2-(3-methylpyrazol-1-yl)-5,6,7,8-tetrahydroquinoline-3-carboximidamide
CID 62488498

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide?
The IUPAC name of 2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide (CID 107346606) is 2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide.
What is the SMILES notation for 2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide?
The canonical SMILES for 2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide is NC(=O)c1cc2c(nc1-n1cc(N)c(C(N)=O)n1)CCC2.
What is the InChIKey of 2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide?
The InChIKey is MTGPGAPMGXRBTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N6O2/c14-8-5-19(18-10(8)12(16)21)13-7(11(15)20)4-6-2-1-3-9(6)17-13/h4-5H,1-3,14H2,(H2,15,20)(H2,16,21).
What are the key properties of 2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide?
2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide has a molecular weight of 286.30 g/mol, XLogP of -0.46, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-3-carbamoylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide is sourced from PubChem (CID 107346606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).