N-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide

C13H15N5O — CID 79354092

IUPACN-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide
SMILESCc1ccnc(NC(=O)C2Cc3nc[nH]c3CN2)c1
InChIInChI=1S/C13H15N5O/c1-8-2-3-14-12(4-8)18-13(19)10-5-9-11(6-15-10)17-7-16-9/h2-4,7,10,15H,5-6H2,1H3,(H,16,17)(H,14,18,19)
InChIKeyLXXMQIKBGKSHQJ-UHFFFAOYSA-N
MW257.30 g/mol
LogP0.77
Rot. Bonds2

About N-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide

N-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide (PubChem CID 79354092) has the molecular formula C13H15N5O and a molecular weight of 257.30 g/mol. Its IUPAC name is N-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide
PubChem CID79354092
Molecular FormulaC13H15N5O
Molecular Weight257.30 g/mol
Exact Mass257.13
IUPAC NameN-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide
SMILESCc1ccnc(NC(=O)C2Cc3nc[nH]c3CN2)c1
InChIInChI=1S/C13H15N5O/c1-8-2-3-14-12(4-8)18-13(19)10-5-9-11(6-15-10)17-7-16-9/h2-4,7,10,15H,5-6H2,1H3,(H,16,17)(H,14,18,19)
InChIKeyLXXMQIKBGKSHQJ-UHFFFAOYSA-N
XLogP0.77
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.30
LogP ≤ 50.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?
The IUPAC name of N-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide (CID 79354092) is N-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide.
What is the SMILES notation for N-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?
The canonical SMILES for N-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide is Cc1ccnc(NC(=O)C2Cc3nc[nH]c3CN2)c1.
What is the InChIKey of N-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?
The InChIKey is LXXMQIKBGKSHQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O/c1-8-2-3-14-12(4-8)18-13(19)10-5-9-11(6-15-10)17-7-16-9/h2-4,7,10,15H,5-6H2,1H3,(H,16,17)(H,14,18,19).
What are the key properties of N-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?
N-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide has a molecular weight of 257.30 g/mol, XLogP of 0.77, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-pyridinyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide is sourced from PubChem (CID 79354092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).