3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide

C19H18N5O+ — CID 123597913

IUPAC3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(NCc1cccnc1)C1=C2C=CC=CN2C(c2ccc[nH+]c2)N1
InChIInChI=1S/C19H17N5O/c25-19(22-12-14-5-3-8-20-11-14)17-16-7-1-2-10-24(16)18(23-17)15-6-4-9-21-13-15/h1-11,13,18,23H,12H2,(H,22,25)/p+1
InChIKeyNAGXBCDWYCMAJO-UHFFFAOYSA-O
MW332.39 g/mol
LogP1.41
Rot. Bonds4

About 3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide

3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 123597913) has the molecular formula C19H18N5O+ and a molecular weight of 332.39 g/mol. Its IUPAC name is 3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound Name3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID123597913
Molecular FormulaC19H18N5O+
Molecular Weight332.39 g/mol
Exact Mass332.15
IUPAC Name3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(NCc1cccnc1)C1=C2C=CC=CN2C(c2ccc[nH+]c2)N1
InChIInChI=1S/C19H17N5O/c25-19(22-12-14-5-3-8-20-11-14)17-16-7-1-2-10-24(16)18(23-17)15-6-4-9-21-13-15/h1-11,13,18,23H,12H2,(H,22,25)/p+1
InChIKeyNAGXBCDWYCMAJO-UHFFFAOYSA-O
XLogP1.41
TPSA71.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.39
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(pyridin-1-ium-3-ylmethyl)-N-pyridin-3-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide
CID 123559067
3-pyridin-3-yl-N-(2,2,2-trifluoro-1-pyridin-3-ylethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide
CID 91352129
1-N-(pyridin-1-ium-3-ylmethyl)-3-N-(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide
CID 3619062
N-(pyridin-3-ylmethyl)pyridine-3-carboxamide;hydrochloride
CID 110755498
2,3,5,6-tetrafluoro-1-N,4-N-bis(pyridin-3-ylmethyl)benzene-1,4-dicarboxamide
CID 1204787
N-(pyridin-3-ylmethyl)cyclopentanecarboxamide
CID 595870
N-(pyridin-3-ylmethyl)cyclobutanecarboxamide
CID 25236359
N-(pyridin-3-ylmethyl)-1H-pyrrolo[3,2-c]pyridine-3-carboxamide
CID 123424448
4-N-benzyl-1-N-(pyridin-3-ylmethyl)piperidine-1,4-dicarboxamide
CID 86911861
1-N-benzyl-4-N-(pyridin-3-ylmethyl)cyclohexane-1,4-dicarboxamide
CID 109147891
2-fluoro-N-(pyridin-3-ylmethyl)benzamide
CID 741479
4-(aminomethyl)-N-(pyridin-3-ylmethyl)benzamide
CID 28545926

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of 3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide (CID 123597913) is 3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for 3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for 3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide is O=C(NCc1cccnc1)C1=C2C=CC=CN2C(c2ccc[nH+]c2)N1.
What is the InChIKey of 3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is NAGXBCDWYCMAJO-UHFFFAOYSA-O. The full InChI is InChI=1S/C19H17N5O/c25-19(22-12-14-5-3-8-20-11-14)17-16-7-1-2-10-24(16)18(23-17)15-6-4-9-21-13-15/h1-11,13,18,23H,12H2,(H,22,25)/p+1.
What are the key properties of 3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide?
3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 332.39 g/mol, XLogP of 1.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-1-ium-3-yl-N-(pyridin-3-ylmethyl)-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 123597913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).