N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide

C17H23N3O2 — CID 119552860

IUPACN-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide
SMILESCN(C(=O)CCCc1ccc2c(c1)CC(=O)N2)C1CCNC1
InChIInChI=1S/C17H23N3O2/c1-20(14-7-8-18-11-14)17(22)4-2-3-12-5-6-15-13(9-12)10-16(21)19-15/h5-6,9,14,18H,2-4,7-8,10-11H2,1H3,(H,19,21)
InChIKeyHDBVMSVSPOHMMJ-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.32
Rot. Bonds5

About N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide

N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide (PubChem CID 119552860) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide.

Molecular Properties

Compound NameN-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide
PubChem CID119552860
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC NameN-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide
SMILESCN(C(=O)CCCc1ccc2c(c1)CC(=O)N2)C1CCNC1
InChIInChI=1S/C17H23N3O2/c1-20(14-7-8-18-11-14)17(22)4-2-3-12-5-6-15-13(9-12)10-16(21)19-15/h5-6,9,14,18H,2-4,7-8,10-11H2,1H3,(H,19,21)
InChIKeyHDBVMSVSPOHMMJ-UHFFFAOYSA-N
XLogP1.32
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-pyrrolidin-3-ylbutanamide
CID 119553466
4-(3,4-difluorophenyl)-N-methyl-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119552359
5-(4-oxopentyl)-1,3-dihydroindol-2-one
CID 116927752
N-(1-aminopropan-2-yl)-N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide;hydrochloride
CID 119583698
N-methyl-4-(4-methylphenyl)-N-piperidin-4-ylbutanamide
CID 119443928
5-butyl-1,3-dihydroindol-2-one
CID 10219749
6-[[methyl(pyrrolidin-3-yl)amino]methyl]-3,4-dihydro-1H-quinolin-2-one
CID 115118915
2-hydroxy-N-methyl-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]acetamide
CID 115140167
4-(4-butylphenyl)-N-methyl-4-oxo-N-pyrrolidin-3-ylbutanamide
CID 119554642
N-methyl-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]carbamoyl chloride
CID 115195045
N-methyl-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-3-carboxamide
CID 115159432
4-amino-N-methyl-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]butanamide
CID 115155349

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide?
The IUPAC name of N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide (CID 119552860) is N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide.
What is the SMILES notation for N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide?
The canonical SMILES for N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide is CN(C(=O)CCCc1ccc2c(c1)CC(=O)N2)C1CCNC1.
What is the InChIKey of N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide?
The InChIKey is HDBVMSVSPOHMMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-20(14-7-8-18-11-14)17(22)4-2-3-12-5-6-15-13(9-12)10-16(21)19-15/h5-6,9,14,18H,2-4,7-8,10-11H2,1H3,(H,19,21).
What are the key properties of N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide?
N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide has a molecular weight of 301.39 g/mol, XLogP of 1.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-N-pyrrolidin-3-ylbutanamide is sourced from PubChem (CID 119552860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).