N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide

C24H30N2O3 — CID 55985016

IUPACN-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide
SMILESCOc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1OC1CCCC1
InChIInChI=1S/C24H30N2O3/c1-28-22-12-11-20(16-23(22)29-21-9-2-3-10-21)25-24(27)19-8-6-7-18(15-19)17-26-13-4-5-14-26/h6-8,11-12,15-16,21H,2-5,9-10,13-14,17H2,1H3,(H,25,27)
InChIKeyIZOZUBWSYNCDPV-UHFFFAOYSA-N
MW394.52 g/mol
LogP4.86
Rot. Bonds7

About N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide

N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide (PubChem CID 55985016) has the molecular formula C24H30N2O3 and a molecular weight of 394.52 g/mol. Its IUPAC name is N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide.

Molecular Properties

Compound NameN-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide
PubChem CID55985016
Molecular FormulaC24H30N2O3
Molecular Weight394.52 g/mol
Exact Mass394.23
IUPAC NameN-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide
SMILESCOc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1OC1CCCC1
InChIInChI=1S/C24H30N2O3/c1-28-22-12-11-20(16-23(22)29-21-9-2-3-10-21)25-24(27)19-8-6-7-18(15-19)17-26-13-4-5-14-26/h6-8,11-12,15-16,21H,2-5,9-10,13-14,17H2,1H3,(H,25,27)
InChIKeyIZOZUBWSYNCDPV-UHFFFAOYSA-N
XLogP4.86
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(propylsulfonylamino)benzamide
CID 31873206
2-[3-[(3-cyclopentyloxy-4-methoxybenzoyl)amino]phenyl]acetic acid
CID 120530673
N-(3-cyclopentyloxy-4-methoxyphenyl)furan-3-carboxamide
CID 31872175
N-[3-(methylcarbamoyl)phenyl]-3-(pyrrolidin-1-ylmethyl)benzamide
CID 146121744
3-[[3-(pyrrolidin-1-ylmethyl)benzoyl]amino]benzoic acid
CID 146134371
N-(3-amino-4-methoxyphenyl)-3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]benzamide
CID 119420036
N-(3-cyclopentyloxy-4-methoxyphenyl)-1-(3-phenylpropyl)piperidine-4-carboxamide
CID 110194127
2-[4-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-N-(4-fluorophenyl)acetamide
CID 5092280
3-cyclopentyloxy-N-(4-fluorophenyl)-4-methoxybenzamide
CID 10404302
methyl 2-[(3-cyclopentyloxy-4-methoxyphenyl)carbamoyl]benzoate
CID 19428226
methyl 3-[2-(3-cyclopentyloxy-4-methoxyphenyl)ethyl]benzoate
CID 23222832
N-(3,4-dimethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109056485

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide?
The IUPAC name of N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide (CID 55985016) is N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide.
What is the SMILES notation for N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide?
The canonical SMILES for N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide is COc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1OC1CCCC1.
What is the InChIKey of N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide?
The InChIKey is IZOZUBWSYNCDPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O3/c1-28-22-12-11-20(16-23(22)29-21-9-2-3-10-21)25-24(27)19-8-6-7-18(15-19)17-26-13-4-5-14-26/h6-8,11-12,15-16,21H,2-5,9-10,13-14,17H2,1H3,(H,25,27).
What are the key properties of N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide?
N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide has a molecular weight of 394.52 g/mol, XLogP of 4.86, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentyloxy-4-methoxyphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide is sourced from PubChem (CID 55985016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).