3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide

C10H12N6O — CID 173158895

IUPAC3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide
SMILESNC(=O)n1ccc(-c2nc3c([nH]2)CNCC3)n1
InChIInChI=1S/C10H12N6O/c11-10(17)16-4-2-7(15-16)9-13-6-1-3-12-5-8(6)14-9/h2,4,12H,1,3,5H2,(H2,11,17)(H,13,14)
InChIKeyYWBHAKOLTTZRBY-UHFFFAOYSA-N
MW232.25 g/mol
LogP-0.15
Rot. Bonds1

About 3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide

3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide (PubChem CID 173158895) has the molecular formula C10H12N6O and a molecular weight of 232.25 g/mol. Its IUPAC name is 3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide.

Molecular Properties

Compound Name3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide
PubChem CID173158895
Molecular FormulaC10H12N6O
Molecular Weight232.25 g/mol
Exact Mass232.11
IUPAC Name3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide
SMILESNC(=O)n1ccc(-c2nc3c([nH]2)CNCC3)n1
InChIInChI=1S/C10H12N6O/c11-10(17)16-4-2-7(15-16)9-13-6-1-3-12-5-8(6)14-9/h2,4,12H,1,3,5H2,(H2,11,17)(H,13,14)
InChIKeyYWBHAKOLTTZRBY-UHFFFAOYSA-N
XLogP-0.15
TPSA101.62 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 5-0.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide?
The IUPAC name of 3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide (CID 173158895) is 3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide.
What is the SMILES notation for 3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide?
The canonical SMILES for 3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide is NC(=O)n1ccc(-c2nc3c([nH]2)CNCC3)n1.
What is the InChIKey of 3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide?
The InChIKey is YWBHAKOLTTZRBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O/c11-10(17)16-4-2-7(15-16)9-13-6-1-3-12-5-8(6)14-9/h2,4,12H,1,3,5H2,(H2,11,17)(H,13,14).
What are the key properties of 3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide?
3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide has a molecular weight of 232.25 g/mol, XLogP of -0.15, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide is sourced from PubChem (CID 173158895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).