4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide

C19H20N2O3 — CID 2304502

IUPAC4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2cccc(C(=O)N3CCCC3)c2)cc1
InChIInChI=1S/C19H20N2O3/c1-24-17-9-7-14(8-10-17)18(22)20-16-6-4-5-15(13-16)19(23)21-11-2-3-12-21/h4-10,13H,2-3,11-12H2,1H3,(H,20,22)
InChIKeyWBHPTEGKDKJDCF-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.18
Rot. Bonds4

About 4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide

4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide (PubChem CID 2304502) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is 4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide
PubChem CID2304502
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2cccc(C(=O)N3CCCC3)c2)cc1
InChIInChI=1S/C19H20N2O3/c1-24-17-9-7-14(8-10-17)18(22)20-16-6-4-5-15(13-16)19(23)21-11-2-3-12-21/h4-10,13H,2-3,11-12H2,1H3,(H,20,22)
InChIKeyWBHPTEGKDKJDCF-UHFFFAOYSA-N
XLogP3.18
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 48041
Encainide Hydrochloride
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3-Amino-4-methoxybenzanilide
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4-Methoxy-N-(4-methoxyphenyl)benzamide
CID 346815
VU0357121
CID 2296132
4-Methoxy-N-(1-naphthyl)benzamide
CID 303390
4-Methoxy-N-phenylbenzohydroxamic acid
CID 777378
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CID 785232
N-(4-Methoxyphenyl)benzoic acid amide
CID 139031
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CID 346046

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide?
The IUPAC name of 4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide (CID 2304502) is 4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide?
The canonical SMILES for 4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide is COc1ccc(C(=O)Nc2cccc(C(=O)N3CCCC3)c2)cc1.
What is the InChIKey of 4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide?
The InChIKey is WBHPTEGKDKJDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-24-17-9-7-14(8-10-17)18(22)20-16-6-4-5-15(13-16)19(23)21-11-2-3-12-21/h4-10,13H,2-3,11-12H2,1H3,(H,20,22).
What are the key properties of 4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide?
4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide has a molecular weight of 324.38 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide is sourced from PubChem (CID 2304502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).