2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide

C13H17N5O — CID 129334440

IUPAC2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide
SMILESCc1ncc(C(=O)NC[C@@H]2CCn3ccnc3C2)[nH]1
InChIInChI=1S/C13H17N5O/c1-9-15-8-11(17-9)13(19)16-7-10-2-4-18-5-3-14-12(18)6-10/h3,5,8,10H,2,4,6-7H2,1H3,(H,15,17)(H,16,19)/t10-/m1/s1
InChIKeyNRJGGNJUXWNFOJ-SNVBAGLBSA-N
MW259.31 g/mol
LogP0.91
Rot. Bonds3

About 2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide

2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide (PubChem CID 129334440) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide
PubChem CID129334440
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide
SMILESCc1ncc(C(=O)NC[C@@H]2CCn3ccnc3C2)[nH]1
InChIInChI=1S/C13H17N5O/c1-9-15-8-11(17-9)13(19)16-7-10-2-4-18-5-3-14-12(18)6-10/h3,5,8,10H,2,4,6-7H2,1H3,(H,15,17)(H,16,19)/t10-/m1/s1
InChIKeyNRJGGNJUXWNFOJ-SNVBAGLBSA-N
XLogP0.91
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide?
The IUPAC name of 2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide (CID 129334440) is 2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide.
What is the SMILES notation for 2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide?
The canonical SMILES for 2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide is Cc1ncc(C(=O)NC[C@@H]2CCn3ccnc3C2)[nH]1.
What is the InChIKey of 2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide?
The InChIKey is NRJGGNJUXWNFOJ-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H17N5O/c1-9-15-8-11(17-9)13(19)16-7-10-2-4-18-5-3-14-12(18)6-10/h3,5,8,10H,2,4,6-7H2,1H3,(H,15,17)(H,16,19)/t10-/m1/s1.
What are the key properties of 2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide?
2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 0.91, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide is sourced from PubChem (CID 129334440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).