5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide

C14H15N5O — CID 128997480

IUPAC5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide
SMILESN#Cc1cc(C(=O)NCC2CCn3ccnc3C2)c[nH]1
InChIInChI=1S/C14H15N5O/c15-7-12-6-11(9-17-12)14(20)18-8-10-1-3-19-4-2-16-13(19)5-10/h2,4,6,9-10,17H,1,3,5,8H2,(H,18,20)
InChIKeyVBQGMTOXYZOTLD-UHFFFAOYSA-N
MW269.31 g/mol
LogP1.08
Rot. Bonds3

About 5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide

5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide (PubChem CID 128997480) has the molecular formula C14H15N5O and a molecular weight of 269.31 g/mol. Its IUPAC name is 5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide.

Molecular Properties

Compound Name5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide
PubChem CID128997480
Molecular FormulaC14H15N5O
Molecular Weight269.31 g/mol
Exact Mass269.13
IUPAC Name5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide
SMILESN#Cc1cc(C(=O)NCC2CCn3ccnc3C2)c[nH]1
InChIInChI=1S/C14H15N5O/c15-7-12-6-11(9-17-12)14(20)18-8-10-1-3-19-4-2-16-13(19)5-10/h2,4,6,9-10,17H,1,3,5,8H2,(H,18,20)
InChIKeyVBQGMTOXYZOTLD-UHFFFAOYSA-N
XLogP1.08
TPSA86.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide with MolForge

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Related Compounds

4-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-2-carboxamide
CID 128967450
4-cyano-2-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)benzamide
CID 129006299
2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-imidazole-5-carboxamide
CID 129334440
2-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)pyrazole-3-carboxamide
CID 129006386
2,5-dimethyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-3-carboxamide
CID 129331405
5-(methoxymethyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1,2-oxazole-3-carboxamide
CID 128996092
1-(2-cyano-2-methylpropyl)-3-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea
CID 129328972
5-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1,3-oxazole-4-carboxamide
CID 129340499
N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 129003003
3,5-dimethyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1,2-oxazole-4-carboxamide
CID 128966217
1-propan-2-yl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrrole-2-carboxamide
CID 129329776
3-ethyl-1-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-carboxamide
CID 129328348

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide?
The IUPAC name of 5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide (CID 128997480) is 5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide.
What is the SMILES notation for 5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide?
The canonical SMILES for 5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide is N#Cc1cc(C(=O)NCC2CCn3ccnc3C2)c[nH]1.
What is the InChIKey of 5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide?
The InChIKey is VBQGMTOXYZOTLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O/c15-7-12-6-11(9-17-12)14(20)18-8-10-1-3-19-4-2-16-13(19)5-10/h2,4,6,9-10,17H,1,3,5,8H2,(H,18,20).
What are the key properties of 5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide?
5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide has a molecular weight of 269.31 g/mol, XLogP of 1.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-1H-pyrrole-3-carboxamide is sourced from PubChem (CID 128997480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).