cyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone

C23H25N3O4 — CID 10386685

IUPACcyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone
SMILESCOc1ccc(-c2nc(C(=O)C3CCCC3)cn2-c2ccc(OCCO)cc2)cn1
InChIInChI=1S/C23H25N3O4/c1-29-21-11-6-17(14-24-21)23-25-20(22(28)16-4-2-3-5-16)15-26(23)18-7-9-19(10-8-18)30-13-12-27/h6-11,14-16,27H,2-5,12-13H2,1H3
InChIKeyBTTPRRYMUQGEEC-UHFFFAOYSA-N
MW407.47 g/mol
LogP3.69
Rot. Bonds8

About cyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone

cyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone (PubChem CID 10386685) has the molecular formula C23H25N3O4 and a molecular weight of 407.47 g/mol. Its IUPAC name is cyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone.

Molecular Properties

Compound Namecyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone
PubChem CID10386685
Molecular FormulaC23H25N3O4
Molecular Weight407.47 g/mol
Exact Mass407.18
IUPAC Namecyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone
SMILESCOc1ccc(-c2nc(C(=O)C3CCCC3)cn2-c2ccc(OCCO)cc2)cn1
InChIInChI=1S/C23H25N3O4/c1-29-21-11-6-17(14-24-21)23-25-20(22(28)16-4-2-3-5-16)15-26(23)18-7-9-19(10-8-18)30-13-12-27/h6-11,14-16,27H,2-5,12-13H2,1H3
InChIKeyBTTPRRYMUQGEEC-UHFFFAOYSA-N
XLogP3.69
TPSA86.47 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.47
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

ethane;1-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]-2-methylpropan-1-one
CID 142920199
4-[2-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)imidazole-4-carbonyl]-1-methylpiperazin-2-one
CID 23110194
[2-(6-methoxy-3-pyridinyl)-1-phenylimidazol-4-yl]-(2,2,4-trimethylpiperazin-1-yl)methanone
CID 23110210
tert-butyl N-[2-[4-[4-acetyl-2-(4-methoxyphenyl)imidazol-1-yl]phenoxy]ethyl]carbamate
CID 142920134
2-[4-[2-(6-methoxy-3-pyridinyl)-5-propan-2-yloxy-1,2,4-triazol-3-yl]phenoxy]ethanol
CID 142920151
N-ethyl-1,2-bis(4-methoxyphenyl)-N-methylimidazole-4-carboxamide
CID 69444871
[5-[4-(2-aminoethoxy)phenyl]-1-(4-methoxyphenyl)pyrazol-3-yl]-cyclopropylmethanone
CID 58806793
(3-fluoropiperidin-1-yl)-[2-(6-methoxy-3-pyridinyl)-1-pyridin-2-ylimidazol-4-yl]methanone
CID 23110123
1-(4-methoxyphenyl)-2-phenylimidazole-4-carboxylic acid
CID 82212229
[5-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)-1,2,4-triazol-3-yl]-piperidin-1-ylmethanone
CID 91238533
2-[4-[3-(difluoromethyl)-1-(6-methoxy-3-pyridinyl)pyrazol-5-yl]phenoxy]ethanol
CID 58806821
(4-methoxyphenyl)-[1-(6-methoxypyridine-3-carbonyl)piperidin-4-yl]methanone
CID 25475529

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone?
The IUPAC name of cyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone (CID 10386685) is cyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone.
What is the SMILES notation for cyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone?
The canonical SMILES for cyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone is COc1ccc(-c2nc(C(=O)C3CCCC3)cn2-c2ccc(OCCO)cc2)cn1.
What is the InChIKey of cyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone?
The InChIKey is BTTPRRYMUQGEEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O4/c1-29-21-11-6-17(14-24-21)23-25-20(22(28)16-4-2-3-5-16)15-26(23)18-7-9-19(10-8-18)30-13-12-27/h6-11,14-16,27H,2-5,12-13H2,1H3.
What are the key properties of cyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone?
cyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone has a molecular weight of 407.47 g/mol, XLogP of 3.69, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[1-[4-(2-hydroxyethoxy)phenyl]-2-(6-methoxy-3-pyridinyl)imidazol-4-yl]methanone is sourced from PubChem (CID 10386685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).