N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide

C24H38N2O4 — CID 143248705

IUPACN-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide
SMILESCOCCCOc1cc(C(=O)N(CCC2CNCC2C)C2CCCC2)ccc1OC
InChIInChI=1S/C24H38N2O4/c1-18-16-25-17-20(18)11-12-26(21-7-4-5-8-21)24(27)19-9-10-22(29-3)23(15-19)30-14-6-13-28-2/h9-10,15,18,20-21,25H,4-8,11-14,16-17H2,1-3H3
InChIKeyXYCXNHWWZGEERT-UHFFFAOYSA-N
MW418.58 g/mol
LogP3.74
Rot. Bonds11

About N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide

N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide (PubChem CID 143248705) has the molecular formula C24H38N2O4 and a molecular weight of 418.58 g/mol. Its IUPAC name is N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide.

Molecular Properties

Compound NameN-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide
PubChem CID143248705
Molecular FormulaC24H38N2O4
Molecular Weight418.58 g/mol
Exact Mass418.28
IUPAC NameN-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide
SMILESCOCCCOc1cc(C(=O)N(CCC2CNCC2C)C2CCCC2)ccc1OC
InChIInChI=1S/C24H38N2O4/c1-18-16-25-17-20(18)11-12-26(21-7-4-5-8-21)24(27)19-9-10-22(29-3)23(15-19)30-14-6-13-28-2/h9-10,15,18,20-21,25H,4-8,11-14,16-17H2,1-3H3
InChIKeyXYCXNHWWZGEERT-UHFFFAOYSA-N
XLogP3.74
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.58
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[(3R,4R)-4-benzylpyrrolidin-3-yl]methyl]-N-cyclobutyl-4-methoxy-3-(3-methoxypropoxy)benzamide;hydrochloride
CID 160780822
N-[[(3R,4R)-4-(cyclobutylamino)pyrrolidin-3-yl]methyl]-4-methoxy-3-(3-methoxypropoxy)-N-propan-2-ylbenzamide
CID 59272068
N-[[(3R,4R)-4-benzylpyrrolidin-3-yl]methyl]-N-cyclopropyl-4-methoxy-3-(3-methoxypropoxy)benzamide
CID 11561524
4-methoxy-3-(3-methoxypropoxy)-N-[(3S)-piperidin-3-yl]-N-propan-2-ylbenzamide
CID 24998743
N-[[(3S,4S)-4-(hydroxymethyl)pyrrolidin-3-yl]methyl]-4-methoxy-3-(3-methoxypropoxy)-N-propan-2-ylbenzamide
CID 11851632
N-[[(3S,4S)-4-[[(2-cyclohexyl-2-methoxyacetyl)-cyclopropylamino]methyl]pyrrolidin-3-yl]methyl]-4-methoxy-3-(3-methoxypropoxy)-N-propan-2-ylbenzamide
CID 68617250
oxan-4-yl N-cyclopropyl-N-[[(3S,4S)-4-[[cyclopropyl-[4-methoxy-3-(3-methoxypropoxy)benzoyl]amino]methyl]pyrrolidin-3-yl]methyl]carbamate
CID 59512474
N-[[(3S,4R)-4-[[cyclobutanecarbonyl(2-methylpropyl)amino]methyl]pyrrolidin-3-yl]methyl]-4-methoxy-3-(3-methoxypropoxy)-N-propan-2-ylbenzamide
CID 90744329
N-cyclopropyl-N-[[(3S,4S)-4-[[[4-methoxy-3-(3-methoxypropoxy)benzoyl]-propan-2-ylamino]methyl]pyrrolidin-3-yl]methyl]oxane-4-carboxamide
CID 11852841
N-[[4-[[cyclopropanecarbonyl(methyl)amino]methyl]pyrrolidin-3-yl]methyl]-4-methoxy-3-(3-methoxypropoxy)-N-propan-2-ylbenzamide
CID 68616994
N-[[(3S,4S)-4-[[(2-cyclohexyl-2-methoxyacetyl)-methylamino]methyl]pyrrolidin-3-yl]methyl]-4-methoxy-3-(3-methoxypropoxy)-N-propan-2-ylbenzamide
CID 68616745
2-methylpropyl N-cyclopropyl-N-[[(3S,4S)-4-[[[4-methoxy-3-(3-methoxypropoxy)benzoyl]-propan-2-ylamino]methyl]pyrrolidin-3-yl]methyl]carbamate
CID 59512286

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide?
The IUPAC name of N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide (CID 143248705) is N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide.
What is the SMILES notation for N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide?
The canonical SMILES for N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide is COCCCOc1cc(C(=O)N(CCC2CNCC2C)C2CCCC2)ccc1OC.
What is the InChIKey of N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide?
The InChIKey is XYCXNHWWZGEERT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H38N2O4/c1-18-16-25-17-20(18)11-12-26(21-7-4-5-8-21)24(27)19-9-10-22(29-3)23(15-19)30-14-6-13-28-2/h9-10,15,18,20-21,25H,4-8,11-14,16-17H2,1-3H3.
What are the key properties of N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide?
N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide has a molecular weight of 418.58 g/mol, XLogP of 3.74, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-methoxy-3-(3-methoxypropoxy)-N-[2-(4-methylpyrrolidin-3-yl)ethyl]benzamide is sourced from PubChem (CID 143248705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).