4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide

C24H27N3O3 — CID 56506249

IUPAC4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide
SMILESCOc1cc(C(=O)Nc2ccc(Cn3ccnc3C)cc2)ccc1OC1CCCC1
InChIInChI=1S/C24H27N3O3/c1-17-25-13-14-27(17)16-18-7-10-20(11-8-18)26-24(28)19-9-12-22(23(15-19)29-2)30-21-5-3-4-6-21/h7-15,21H,3-6,16H2,1-2H3,(H,26,28)
InChIKeyVTWJYVRJWPCGJC-UHFFFAOYSA-N
MW405.50 g/mol
LogP4.82
Rot. Bonds7

About 4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide

4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide (PubChem CID 56506249) has the molecular formula C24H27N3O3 and a molecular weight of 405.50 g/mol. Its IUPAC name is 4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide.

Molecular Properties

Compound Name4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide
PubChem CID56506249
Molecular FormulaC24H27N3O3
Molecular Weight405.50 g/mol
Exact Mass405.21
IUPAC Name4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide
SMILESCOc1cc(C(=O)Nc2ccc(Cn3ccnc3C)cc2)ccc1OC1CCCC1
InChIInChI=1S/C24H27N3O3/c1-17-25-13-14-27(17)16-18-7-10-20(11-8-18)26-24(28)19-9-12-22(23(15-19)29-2)30-21-5-3-4-6-21/h7-15,21H,3-6,16H2,1-2H3,(H,26,28)
InChIKeyVTWJYVRJWPCGJC-UHFFFAOYSA-N
XLogP4.82
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.50
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide
CID 46775326
N-(3,4-dimethylphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide
CID 43919290
N-[4-[2-(3-cyclopentyloxy-4-methoxyphenyl)ethylcarbamoyl]phenyl]-3,4-dimethoxybenzamide
CID 142662106
3-cyclopentyloxy-N-(4-fluorophenyl)-4-methoxybenzamide
CID 10404302
N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide
CID 56513537
N-(4-bromo-3-chlorophenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide
CID 43924902
cyclohexyl 4-[(3,4-dimethoxybenzoyl)amino]benzoate
CID 985959
N-[5-chloro-2-(2-methoxyphenoxy)phenyl]-4-[(2-methylimidazol-1-yl)methyl]benzamide
CID 46765943
4-[(2-methylimidazol-1-yl)methyl]-N-propan-2-ylbenzamide
CID 43918417
4-cyclopentyloxy-N-(2,5-dimethoxyphenyl)-3-methoxybenzamide
CID 55792810
N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]-3-[(3-methylphenyl)methoxy]benzamide
CID 56506117
2-methyl-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]-1-phenylbenzimidazole-5-carboxamide
CID 56512878

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide?
The IUPAC name of 4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide (CID 56506249) is 4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide.
What is the SMILES notation for 4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide?
The canonical SMILES for 4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide is COc1cc(C(=O)Nc2ccc(Cn3ccnc3C)cc2)ccc1OC1CCCC1.
What is the InChIKey of 4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide?
The InChIKey is VTWJYVRJWPCGJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O3/c1-17-25-13-14-27(17)16-18-7-10-20(11-8-18)26-24(28)19-9-12-22(23(15-19)29-2)30-21-5-3-4-6-21/h7-15,21H,3-6,16H2,1-2H3,(H,26,28).
What are the key properties of 4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide?
4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide has a molecular weight of 405.50 g/mol, XLogP of 4.82, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide is sourced from PubChem (CID 56506249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).