[3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone

C26H28N6O — CID 97447152

IUPAC[3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone
SMILESO=C(c1nc(-c2cn(C3CCCC3)cn2)n2ccccc12)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C26H28N6O/c33-26(30-16-14-29(15-17-30)20-8-2-1-3-9-20)24-23-12-6-7-13-32(23)25(28-24)22-18-31(19-27-22)21-10-4-5-11-21/h1-3,6-9,12-13,18-19,21H,4-5,10-11,14-17H2
InChIKeyHYERKSUROUOARK-UHFFFAOYSA-N
MW440.55 g/mol
LogP4.28
Rot. Bonds4

About [3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone

[3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone (PubChem CID 97447152) has the molecular formula C26H28N6O and a molecular weight of 440.55 g/mol. Its IUPAC name is [3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name[3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone
PubChem CID97447152
Molecular FormulaC26H28N6O
Molecular Weight440.55 g/mol
Exact Mass440.23
IUPAC Name[3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone
SMILESO=C(c1nc(-c2cn(C3CCCC3)cn2)n2ccccc12)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C26H28N6O/c33-26(30-16-14-29(15-17-30)20-8-2-1-3-9-20)24-23-12-6-7-13-32(23)25(28-24)22-18-31(19-27-22)21-10-4-5-11-21/h1-3,6-9,12-13,18-19,21H,4-5,10-11,14-17H2
InChIKeyHYERKSUROUOARK-UHFFFAOYSA-N
XLogP4.28
TPSA58.67 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.55
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

[3-(1-benzylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-pyridin-4-ylpiperazin-1-yl)methanone
CID 97447020
[3-[1-(cyclohexylmethyl)imidazol-4-yl]imidazo[1,5-a]pyridin-1-yl]-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone
CID 97447146
(3-methylimidazo[1,5-a]pyridin-1-yl)-[4-(3-methylphenyl)piperazin-1-yl]methanone
CID 110648923
(4-methyl-1,4-diazepan-1-yl)-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]methanone
CID 97447078
[3-(1-benzyl-2-methylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-pyrrolidin-1-ylmethanone
CID 97447183
[3-(1-benzyl-2-methylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-methylpiperazin-1-yl)methanone
CID 97447182
1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide
CID 109071234
(3-tert-butylimidazo[1,5-a]pyridin-1-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 110414706
1-[4-[3-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carbonyl]piperazin-1-yl]ethanone
CID 109068040
[2-(cyclopentylamino)-4-pyridinyl]-(4-phenylpiperazin-1-yl)methanone
CID 109166097
(4-cyclopentylpiperazin-1-yl)-(4-methoxy-1-phenylpyrazol-3-yl)methanone
CID 134020644
3-(1-benzylimidazol-4-yl)-N-[[(2R)-oxolan-2-yl]methyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 97447006

Frequently Asked Questions

What is the IUPAC name of [3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone?
The IUPAC name of [3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone (CID 97447152) is [3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone.
What is the SMILES notation for [3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone?
The canonical SMILES for [3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone is O=C(c1nc(-c2cn(C3CCCC3)cn2)n2ccccc12)N1CCN(c2ccccc2)CC1.
What is the InChIKey of [3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone?
The InChIKey is HYERKSUROUOARK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28N6O/c33-26(30-16-14-29(15-17-30)20-8-2-1-3-9-20)24-23-12-6-7-13-32(23)25(28-24)22-18-31(19-27-22)21-10-4-5-11-21/h1-3,6-9,12-13,18-19,21H,4-5,10-11,14-17H2.
What are the key properties of [3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone?
[3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone has a molecular weight of 440.55 g/mol, XLogP of 4.28, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone is sourced from PubChem (CID 97447152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).