N-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide

C22H28N4O3 — CID 109074865

IUPACN-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2nc(C(=O)N3CCC(C)CC3)c3n2CCCC3)cc1
InChIInChI=1S/C22H28N4O3/c1-15-10-13-25(14-11-15)22(28)19-18-5-3-4-12-26(18)20(24-19)21(27)23-16-6-8-17(29-2)9-7-16/h6-9,15H,3-5,10-14H2,1-2H3,(H,23,27)
InChIKeyHKTXEYYQBNAEME-UHFFFAOYSA-N
MW396.49 g/mol
LogP3.35
Rot. Bonds4

About N-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide

N-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 109074865) has the molecular formula C22H28N4O3 and a molecular weight of 396.49 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
PubChem CID109074865
Molecular FormulaC22H28N4O3
Molecular Weight396.49 g/mol
Exact Mass396.22
IUPAC NameN-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2nc(C(=O)N3CCC(C)CC3)c3n2CCCC3)cc1
InChIInChI=1S/C22H28N4O3/c1-15-10-13-25(14-11-15)22(28)19-18-5-3-4-12-26(18)20(24-19)21(27)23-16-6-8-17(29-2)9-7-16/h6-9,15H,3-5,10-14H2,1-2H3,(H,23,27)
InChIKeyHKTXEYYQBNAEME-UHFFFAOYSA-N
XLogP3.35
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.49
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-methylpiperidine-1-carbonyl)-N-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
CID 109072570
3-N-cyclopentyl-1-N-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109074492
3-N-cyclohexyl-1-N-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109074806
N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
CID 109074186
[3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]-pyrrolidin-1-ylmethanone
CID 109074080
[3-(azepane-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]-(4-methylpiperidin-1-yl)methanone
CID 109074845
(4-methylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanone
CID 109074603
1-(4-methylpiperidine-1-carbonyl)-N-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
CID 109074834
1-(azepane-1-carbonyl)-N-(3,4-dimethylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
CID 109077385
N-(4-cyanophenyl)-1-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
CID 109074597
1-N-(4-methoxyphenyl)-3-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109075591
1-N-(4-methoxyphenyl)-3-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109077026

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide (CID 109074865) is N-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide is COc1ccc(NC(=O)c2nc(C(=O)N3CCC(C)CC3)c3n2CCCC3)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is HKTXEYYQBNAEME-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O3/c1-15-10-13-25(14-11-15)22(28)19-18-5-3-4-12-26(18)20(24-19)21(27)23-16-6-8-17(29-2)9-7-16/h6-9,15H,3-5,10-14H2,1-2H3,(H,23,27).
What are the key properties of N-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?
N-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 396.49 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-1-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 109074865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).