3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide

C16H24N2O2 — CID 110737506

IUPAC3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide
SMILESCOc1cccc(CCC(=O)NCC2CCN(C)C2)c1
InChIInChI=1S/C16H24N2O2/c1-18-9-8-14(12-18)11-17-16(19)7-6-13-4-3-5-15(10-13)20-2/h3-5,10,14H,6-9,11-12H2,1-2H3,(H,17,19)
InChIKeyJLMLZFSKVBSEGS-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.70
Rot. Bonds6

About 3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide

3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide (PubChem CID 110737506) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide.

Molecular Properties

Compound Name3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide
PubChem CID110737506
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide
SMILESCOc1cccc(CCC(=O)NCC2CCN(C)C2)c1
InChIInChI=1S/C16H24N2O2/c1-18-9-8-14(12-18)11-17-16(19)7-6-13-4-3-5-15(10-13)20-2/h3-5,10,14H,6-9,11-12H2,1-2H3,(H,17,19)
InChIKeyJLMLZFSKVBSEGS-UHFFFAOYSA-N
XLogP1.70
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide 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

3-(3-methoxyphenyl)-N-[[1-(2,2,2-trifluoroacetyl)piperidin-4-yl]methyl]propanamide
CID 108932878
tert-butyl N-[2-[4-[[3-(3-methoxyphenyl)propanoylamino]methyl]piperidin-1-yl]-2-oxoethyl]carbamate
CID 108916612
3-(3-fluorophenyl)-N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]propanamide
CID 60599829
2-(3-hydroxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]acetamide
CID 61400257
3-(4-methoxyphenyl)-N-[(1-phenylpyrrolidin-3-yl)methyl]propanamide
CID 46402981
2-(3-methoxyphenyl)sulfanyl-N-[(1-methylpiperidin-3-yl)methyl]acetamide
CID 56783989
2-(3-methoxyphenyl)sulfanyl-N-[[(3S)-1-methylpiperidin-3-yl]methyl]acetamide
CID 95617068
2-(3-methoxyphenyl)sulfanyl-N-[[(3R)-1-methylpiperidin-3-yl]methyl]acetamide
CID 95617067
N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide
CID 63294459
N-[(3-methoxyphenyl)methyl]-1-methylpiperidine-4-carboxamide
CID 70985796
3-(3-methoxyphenyl)-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]propanamide
CID 110725983
3-(3-methoxyphenyl)-N-[2-methyl-2-(3-methylpiperidin-1-yl)propyl]propanamide
CID 60568816

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide?
The IUPAC name of 3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide (CID 110737506) is 3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide.
What is the SMILES notation for 3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide?
The canonical SMILES for 3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide is COc1cccc(CCC(=O)NCC2CCN(C)C2)c1.
What is the InChIKey of 3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide?
The InChIKey is JLMLZFSKVBSEGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-18-9-8-14(12-18)11-17-16(19)7-6-13-4-3-5-15(10-13)20-2/h3-5,10,14H,6-9,11-12H2,1-2H3,(H,17,19).
What are the key properties of 3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide?
3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide has a molecular weight of 276.38 g/mol, XLogP of 1.70, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide is sourced from PubChem (CID 110737506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).