N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide

C12H16N6O — CID 104618699

IUPACN-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide
SMILESCc1[nH]nc(NC(=O)C2Cc3nc[nH]c3CN2)c1C
InChIInChI=1S/C12H16N6O/c1-6-7(2)17-18-11(6)16-12(19)9-3-8-10(4-13-9)15-5-14-8/h5,9,13H,3-4H2,1-2H3,(H,14,15)(H2,16,17,18,19)
InChIKeyWCRCZQPNUFHQQU-UHFFFAOYSA-N
MW260.30 g/mol
LogP0.40
Rot. Bonds2

About N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide

N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide (PubChem CID 104618699) has the molecular formula C12H16N6O and a molecular weight of 260.30 g/mol. Its IUPAC name is N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide
PubChem CID104618699
Molecular FormulaC12H16N6O
Molecular Weight260.30 g/mol
Exact Mass260.14
IUPAC NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide
SMILESCc1[nH]nc(NC(=O)C2Cc3nc[nH]c3CN2)c1C
InChIInChI=1S/C12H16N6O/c1-6-7(2)17-18-11(6)16-12(19)9-3-8-10(4-13-9)15-5-14-8/h5,9,13H,3-4H2,1-2H3,(H,14,15)(H2,16,17,18,19)
InChIKeyWCRCZQPNUFHQQU-UHFFFAOYSA-N
XLogP0.40
TPSA98.49 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 50.40
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?
The IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide (CID 104618699) is N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide.
What is the SMILES notation for N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?
The canonical SMILES for N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide is Cc1[nH]nc(NC(=O)C2Cc3nc[nH]c3CN2)c1C.
What is the InChIKey of N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?
The InChIKey is WCRCZQPNUFHQQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N6O/c1-6-7(2)17-18-11(6)16-12(19)9-3-8-10(4-13-9)15-5-14-8/h5,9,13H,3-4H2,1-2H3,(H,14,15)(H2,16,17,18,19).
What are the key properties of N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?
N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide has a molecular weight of 260.30 g/mol, XLogP of 0.40, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide is sourced from PubChem (CID 104618699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).