N-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide

C23H26N4O2 — CID 110630596

IUPACN-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(NCCNC(=O)c1nc(C2CCCCC2)n2ccccc12)c1ccccc1
InChIInChI=1S/C23H26N4O2/c28-22(18-11-5-2-6-12-18)24-14-15-25-23(29)20-19-13-7-8-16-27(19)21(26-20)17-9-3-1-4-10-17/h2,5-8,11-13,16-17H,1,3-4,9-10,14-15H2,(H,24,28)(H,25,29)
InChIKeyVNFVOVLYFAYUIP-UHFFFAOYSA-N
MW390.49 g/mol
LogP3.54
Rot. Bonds6

About N-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide

N-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 110630596) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is N-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID110630596
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC NameN-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(NCCNC(=O)c1nc(C2CCCCC2)n2ccccc12)c1ccccc1
InChIInChI=1S/C23H26N4O2/c28-22(18-11-5-2-6-12-18)24-14-15-25-23(29)20-19-13-7-8-16-27(19)21(26-20)17-9-3-1-4-10-17/h2,5-8,11-13,16-17H,1,3-4,9-10,14-15H2,(H,24,28)(H,25,29)
InChIKeyVNFVOVLYFAYUIP-UHFFFAOYSA-N
XLogP3.54
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-acetamidopropyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide
CID 110630721
3-cyclohexyl-N-(imidazo[1,5-a]pyridin-3-ylmethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 110609993
N-(3-acetamidopropyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide
CID 110630719
3-cyclopropyl-N-(2-oxo-2-piperidin-1-ylethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 110633499
3-cyclopropyl-N-[[1-(hydroxymethyl)cyclobutyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 57453264
3-cyclopropyl-N-(2,2-dimethylpropyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 54580175
N-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide
CID 110626369
ethyl 4-[(3-cyclohexylimidazo[1,5-a]pyridine-1-carbonyl)amino]piperidine-1-carboxylate
CID 110413306
3-cyclopropyl-N-[(4-fluorophenyl)methyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 69006617
3-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)ethyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 110412652
3-(1-benzoylpyrrolidin-2-yl)-N-(2-piperidin-1-ylethyl)imidazo[1,5-a]pyridine-1-carboxamide;2,2,2-trifluoroacetic acid
CID 155826621
3-cyclopropyl-N-[2-(2,4-dimethoxyphenyl)ethyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 110607033

Frequently Asked Questions

What is the IUPAC name of N-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide (CID 110630596) is N-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide is O=C(NCCNC(=O)c1nc(C2CCCCC2)n2ccccc12)c1ccccc1.
What is the InChIKey of N-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is VNFVOVLYFAYUIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c28-22(18-11-5-2-6-12-18)24-14-15-25-23(29)20-19-13-7-8-16-27(19)21(26-20)17-9-3-1-4-10-17/h2,5-8,11-13,16-17H,1,3-4,9-10,14-15H2,(H,24,28)(H,25,29).
What are the key properties of N-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide?
N-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 390.49 g/mol, XLogP of 3.54, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzamidoethyl)-3-cyclohexylimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 110630596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).