2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide

C19H21N3O2 — CID 119552674

IUPAC2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide
SMILESCN(C(=O)c1ccccc1NC(=O)c1ccccc1)C1CCNC1
InChIInChI=1S/C19H21N3O2/c1-22(15-11-12-20-13-15)19(24)16-9-5-6-10-17(16)21-18(23)14-7-3-2-4-8-14/h2-10,15,20H,11-13H2,1H3,(H,21,23)
InChIKeyJHLIDIVESDZXFL-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.37
Rot. Bonds4

About 2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide

2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide (PubChem CID 119552674) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide.

Molecular Properties

Compound Name2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide
PubChem CID119552674
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide
SMILESCN(C(=O)c1ccccc1NC(=O)c1ccccc1)C1CCNC1
InChIInChI=1S/C19H21N3O2/c1-22(15-11-12-20-13-15)19(24)16-9-5-6-10-17(16)21-18(23)14-7-3-2-4-8-14/h2-10,15,20H,11-13H2,1H3,(H,21,23)
InChIKeyJHLIDIVESDZXFL-UHFFFAOYSA-N
XLogP2.37
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[(3-methylbenzoyl)amino]-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119551107
N-[2-methyl-6-[methyl(pyrrolidin-3-yl)carbamoyl]phenyl]pyridine-4-carboxamide
CID 119551533
2-benzamido-N-(3-methylpiperidin-4-yl)benzamide
CID 120557141
N-methyl-2-(4-methylbenzoyl)-N-[(3R)-pyrrolidin-3-yl]benzamide
CID 124613629
2-benzamido-N-piperidin-4-ylbenzamide
CID 119388442
N-methyl-2-phenylmethoxy-N-pyrrolidin-3-ylbenzamide
CID 72544793
2,3-difluoro-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119554382
N-cyclohexyl-N-methyl-2-[(3-methylbenzoyl)amino]benzamide
CID 4938871
3-hydroxy-N,2-dimethyl-N-pyrrolidin-3-ylbenzamide
CID 82829855
2-[(4-methoxyphenyl)sulfonylamino]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119551446
N-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]benzamide
CID 60807055
1-N,3-N-dimethyl-1-N-phenyl-3-N-pyrrolidin-3-ylbenzene-1,3-dicarboxamide
CID 119552240

Frequently Asked Questions

What is the IUPAC name of 2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide?
The IUPAC name of 2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide (CID 119552674) is 2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide.
What is the SMILES notation for 2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide?
The canonical SMILES for 2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide is CN(C(=O)c1ccccc1NC(=O)c1ccccc1)C1CCNC1.
What is the InChIKey of 2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide?
The InChIKey is JHLIDIVESDZXFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-22(15-11-12-20-13-15)19(24)16-9-5-6-10-17(16)21-18(23)14-7-3-2-4-8-14/h2-10,15,20H,11-13H2,1H3,(H,21,23).
What are the key properties of 2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide?
2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide has a molecular weight of 323.40 g/mol, XLogP of 2.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzamido-N-methyl-N-pyrrolidin-3-ylbenzamide is sourced from PubChem (CID 119552674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).