N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride

C16H25ClN2O4 — CID 119803301

IUPACN-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCOCCN(C(=O)C1CCNC1)c1ccc(OC)c(OC)c1.Cl
InChIInChI=1S/C16H24N2O4.ClH/c1-20-9-8-18(16(19)12-6-7-17-11-12)13-4-5-14(21-2)15(10-13)22-3;/h4-5,10,12,17H,6-9,11H2,1-3H3;1H
InChIKeyLQJSOTQRNDVWTA-UHFFFAOYSA-N
MW344.84 g/mol
LogP1.71
Rot. Bonds7

About N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride

N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride (PubChem CID 119803301) has the molecular formula C16H25ClN2O4 and a molecular weight of 344.84 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride
PubChem CID119803301
Molecular FormulaC16H25ClN2O4
Molecular Weight344.84 g/mol
Exact Mass344.15
IUPAC NameN-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCOCCN(C(=O)C1CCNC1)c1ccc(OC)c(OC)c1.Cl
InChIInChI=1S/C16H24N2O4.ClH/c1-20-9-8-18(16(19)12-6-7-17-11-12)13-4-5-14(21-2)15(10-13)22-3;/h4-5,10,12,17H,6-9,11H2,1-3H3;1H
InChIKeyLQJSOTQRNDVWTA-UHFFFAOYSA-N
XLogP1.71
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.84
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride 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

4-[(3,4-dimethoxyphenyl)-(2-methoxyethyl)carbamoyl]benzoic acid
CID 119186551
N-benzyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide
CID 63007100
N-ethyl-N-(4-methylphenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119706995
N-butyl-N-phenylpyrrolidine-3-carboxamide;hydrochloride
CID 119679273
N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)-4-(methylamino)butanamide;hydrochloride
CID 119803271
N-[3-(3,5-dimethoxyphenoxy)propyl]-N-methylpyrrolidine-3-carboxamide;hydrochloride
CID 119820838
N-ethyl-N-phenylpyrrolidine-3-carboxamide;hydrochloride
CID 119670332
N-(3,4-dimethoxyphenyl)-N-piperidin-4-ylacetamide
CID 14698197
(3R)-N-[2-(2-methoxyphenyl)ethyl]-N-methylpyrrolidine-3-carboxamide
CID 124685580
(5-chloro-2-methoxyphenyl)-pyrrolidin-3-ylmethanone
CID 116568381
N-(3-amino-3-oxopropyl)-N-(3-methylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119311461
ethyl 2-[2-methoxyethyl(pyrrolidine-3-carbonyl)amino]acetate
CID 63005164

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride (CID 119803301) is N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride is COCCN(C(=O)C1CCNC1)c1ccc(OC)c(OC)c1.Cl.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride?
The InChIKey is LQJSOTQRNDVWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O4.ClH/c1-20-9-8-18(16(19)12-6-7-17-11-12)13-4-5-14(21-2)15(10-13)22-3;/h4-5,10,12,17H,6-9,11H2,1-3H3;1H.
What are the key properties of N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride?
N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride has a molecular weight of 344.84 g/mol, XLogP of 1.71, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119803301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).