3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide

C20H24N2O2 — CID 110361627

IUPAC3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide
SMILESCOc1cccc(CCC(=O)Nc2cccc(N3CCCC3)c2)c1
InChIInChI=1S/C20H24N2O2/c1-24-19-9-4-6-16(14-19)10-11-20(23)21-17-7-5-8-18(15-17)22-12-2-3-13-22/h4-9,14-15H,2-3,10-13H2,1H3,(H,21,23)
InChIKeyXHKIZIXVODOVBK-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.87
Rot. Bonds6

About 3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide

3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide (PubChem CID 110361627) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide.

Molecular Properties

Compound Name3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide
PubChem CID110361627
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide
SMILESCOc1cccc(CCC(=O)Nc2cccc(N3CCCC3)c2)c1
InChIInChI=1S/C20H24N2O2/c1-24-19-9-4-6-16(14-19)10-11-20(23)21-17-7-5-8-18(15-17)22-12-2-3-13-22/h4-9,14-15H,2-3,10-13H2,1H3,(H,21,23)
InChIKeyXHKIZIXVODOVBK-UHFFFAOYSA-N
XLogP3.87
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(4-acetylpiperazin-1-yl)phenyl]-3-(3-methoxyphenyl)propanamide
CID 110368212
3-(3,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)propanamide
CID 26689927
3-(3-methoxyphenyl)-N-(3-propan-2-ylphenyl)propanamide
CID 36568159
3-[(3,5-dimethoxyphenyl)methylamino]-N-(3-pyrrolidin-1-ylphenyl)butanamide
CID 119107334
3-(3-methoxyphenyl)-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)propanamide
CID 34367905
N-(3-ethylphenyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 8592549
3-(4-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)butanamide
CID 110618601
ethyl 4-oxo-4-(3-pyrrolidin-1-ylanilino)butanoate
CID 61062260
3-(3-aminophenyl)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 28713584
3-(2-hydroxyphenyl)-N-(3-piperidin-1-ylphenyl)propanamide
CID 47070895
4-(3-methoxyphenyl)-N-(3-morpholin-4-ylphenyl)-4-oxobutanamide
CID 110613002
4-(methylamino)-N-(3-pyrrolidin-1-ylphenyl)butanamide
CID 54862533

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide?
The IUPAC name of 3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide (CID 110361627) is 3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide.
What is the SMILES notation for 3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide?
The canonical SMILES for 3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide is COc1cccc(CCC(=O)Nc2cccc(N3CCCC3)c2)c1.
What is the InChIKey of 3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide?
The InChIKey is XHKIZIXVODOVBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-24-19-9-4-6-16(14-19)10-11-20(23)21-17-7-5-8-18(15-17)22-12-2-3-13-22/h4-9,14-15H,2-3,10-13H2,1H3,(H,21,23).
What are the key properties of 3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide?
3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide has a molecular weight of 324.42 g/mol, XLogP of 3.87, 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-(3-pyrrolidin-1-ylphenyl)propanamide is sourced from PubChem (CID 110361627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).