N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide

C23H25N3O2 — CID 46775326

IUPACN-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide
SMILESCc1nccn1Cc1ccc(C(=O)Nc2ccc(OC3CCCC3)cc2)cc1
InChIInChI=1S/C23H25N3O2/c1-17-24-14-15-26(17)16-18-6-8-19(9-7-18)23(27)25-20-10-12-22(13-11-20)28-21-4-2-3-5-21/h6-15,21H,2-5,16H2,1H3,(H,25,27)
InChIKeyYCUYMBOCMDOQHD-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.81
Rot. Bonds6

About N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide

N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide (PubChem CID 46775326) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide.

Molecular Properties

Compound NameN-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide
PubChem CID46775326
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC NameN-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide
SMILESCc1nccn1Cc1ccc(C(=O)Nc2ccc(OC3CCCC3)cc2)cc1
InChIInChI=1S/C23H25N3O2/c1-17-24-14-15-26(17)16-18-6-8-19(9-7-18)23(27)25-20-10-12-22(13-11-20)28-21-4-2-3-5-21/h6-15,21H,2-5,16H2,1H3,(H,25,27)
InChIKeyYCUYMBOCMDOQHD-UHFFFAOYSA-N
XLogP4.81
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-cyclopentyloxy-3-methoxy-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]benzamide
CID 56506249
4-[(2-methylimidazol-1-yl)methyl]-N-(4-phenylmethoxyphenyl)benzamide
CID 43922241
N-(3,4-dimethylphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide
CID 43919290
N-(4-cyclopentyloxyphenyl)-4-ethoxybenzamide
CID 36565370
4-[(2-methylimidazol-1-yl)methyl]-N-propan-2-ylbenzamide
CID 43918417
N-(3-acetamidophenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide
CID 43925818
N-(4-cyclopentyloxyphenyl)pyridine-4-carboxamide;hydrochloride
CID 110777040
N-(4-bromo-3-chlorophenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide
CID 43924902
N-[4-chloro-3-(trifluoromethyl)phenyl]-4-[(2-methylimidazol-1-yl)methyl]benzamide
CID 43922204
N-[4-(1-methylpiperidin-4-yl)oxyphenyl]-4-(piperidin-1-ylmethyl)benzamide
CID 53277962
4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide
CID 39100305
N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide
CID 56513537

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide?
The IUPAC name of N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide (CID 46775326) is N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide.
What is the SMILES notation for N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide?
The canonical SMILES for N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide is Cc1nccn1Cc1ccc(C(=O)Nc2ccc(OC3CCCC3)cc2)cc1.
What is the InChIKey of N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide?
The InChIKey is YCUYMBOCMDOQHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-17-24-14-15-26(17)16-18-6-8-19(9-7-18)23(27)25-20-10-12-22(13-11-20)28-21-4-2-3-5-21/h6-15,21H,2-5,16H2,1H3,(H,25,27).
What are the key properties of N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide?
N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide has a molecular weight of 375.47 g/mol, XLogP of 4.81, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide is sourced from PubChem (CID 46775326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).