N-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide

C15H21N3O2 — CID 106257709

IUPACN-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)NC1CCN(C)C1=O
InChIInChI=1S/C15H21N3O2/c1-3-9-16-12-7-5-4-6-11(12)14(19)17-13-8-10-18(2)15(13)20/h4-7,13,16H,3,8-10H2,1-2H3,(H,17,19)
InChIKeyZUDDLLYXNJHQEP-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.47
Rot. Bonds5

About N-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide

N-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide (PubChem CID 106257709) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide
PubChem CID106257709
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)NC1CCN(C)C1=O
InChIInChI=1S/C15H21N3O2/c1-3-9-16-12-7-5-4-6-11(12)14(19)17-13-8-10-18(2)15(13)20/h4-7,13,16H,3,8-10H2,1-2H3,(H,17,19)
InChIKeyZUDDLLYXNJHQEP-UHFFFAOYSA-N
XLogP1.47
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxyanilino)-N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]benzamide
CID 124625314
N-cyclooctyl-2-(propylamino)benzamide
CID 63500402
3-amino-2-ethoxy-N-(1-methyl-2-oxopyrrolidin-3-yl)benzamide
CID 106249454
N-(2-hydroxycyclohexyl)-2-(propylamino)benzamide
CID 62361158
N-(3,5-dimethylcyclohexyl)-2-(propylamino)benzamide
CID 64732342
2-bromo-3-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)benzamide
CID 103855167
2-bromo-3-fluoro-N-(1-methyl-2-oxopyrrolidin-3-yl)benzamide
CID 114164962
N-(2-piperidin-1-ylethyl)-2-(propylamino)benzamide
CID 62175413
N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide
CID 62168218
N-(1-ethenylpiperidin-4-yl)-2-(ethylamino)benzamide
CID 143660133
2-(ethylamino)-N-(4-methylcyclohexyl)benzamide
CID 62171591
N-cyclopropyl-2-[[2-oxo-2-(propylamino)ethyl]amino]benzamide
CID 32906957

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide?
The IUPAC name of N-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide (CID 106257709) is N-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide.
What is the SMILES notation for N-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide?
The canonical SMILES for N-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide is CCCNc1ccccc1C(=O)NC1CCN(C)C1=O.
What is the InChIKey of N-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide?
The InChIKey is ZUDDLLYXNJHQEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-3-9-16-12-7-5-4-6-11(12)14(19)17-13-8-10-18(2)15(13)20/h4-7,13,16H,3,8-10H2,1-2H3,(H,17,19).
What are the key properties of N-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide?
N-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide has a molecular weight of 275.35 g/mol, XLogP of 1.47, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-2-oxopyrrolidin-3-yl)-2-(propylamino)benzamide is sourced from PubChem (CID 106257709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).