1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide

C22H30N4O2 — CID 109071234

IUPAC1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NC1CCCCCC1)c1nc(C(=O)N2CCCCCC2)c2ccccn12
InChIInChI=1S/C22H30N4O2/c27-21(23-17-11-5-1-2-6-12-17)20-24-19(18-13-7-10-16-26(18)20)22(28)25-14-8-3-4-9-15-25/h7,10,13,16-17H,1-6,8-9,11-12,14-15H2,(H,23,27)
InChIKeyUDMNAKJQWNKQQB-UHFFFAOYSA-N
MW382.51 g/mol
LogP3.80
Rot. Bonds3

About 1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide

1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 109071234) has the molecular formula C22H30N4O2 and a molecular weight of 382.51 g/mol. Its IUPAC name is 1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide
PubChem CID109071234
Molecular FormulaC22H30N4O2
Molecular Weight382.51 g/mol
Exact Mass382.24
IUPAC Name1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NC1CCCCCC1)c1nc(C(=O)N2CCCCCC2)c2ccccn12
InChIInChI=1S/C22H30N4O2/c27-21(23-17-11-5-1-2-6-12-17)20-24-19(18-13-7-10-16-26(18)20)22(28)25-14-8-3-4-9-15-25/h7,10,13,16-17H,1-6,8-9,11-12,14-15H2,(H,23,27)
InChIKeyUDMNAKJQWNKQQB-UHFFFAOYSA-N
XLogP3.80
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.51
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-N-cyclohexyl-1-N-cyclopentylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068157
N-cyclopentyl-1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109068289
N-cyclopropyl-1-(4-methylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109066655
N-cycloheptyl-3-(4-methylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109069951
N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109066656
1-(piperidine-1-carbonyl)-N-propan-2-ylimidazo[1,5-a]pyridine-3-carboxamide
CID 109066328
1-N-tert-butyl-3-N-cycloheptylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071055
3-N-cyclohexyl-1-N-(2-methylpropyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067383
3-N-cyclohexyl-1-N-(3-methylbutyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068652
N-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109068588
1-(piperidine-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide
CID 109066963
1-(azepane-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide
CID 109067029

Frequently Asked Questions

What is the IUPAC name of 1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide (CID 109071234) is 1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide is O=C(NC1CCCCCC1)c1nc(C(=O)N2CCCCCC2)c2ccccn12.
What is the InChIKey of 1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is UDMNAKJQWNKQQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N4O2/c27-21(23-17-11-5-1-2-6-12-17)20-24-19(18-13-7-10-16-26(18)20)22(28)25-14-8-3-4-9-15-25/h7,10,13,16-17H,1-6,8-9,11-12,14-15H2,(H,23,27).
What are the key properties of 1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide?
1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 382.51 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 109071234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).