N-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide

C14H17N3O2 — CID 107422530

IUPACN-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide
SMILESCC1(NC(=O)c2ccc3c(c2)CC(=O)N3)CCNC1
InChIInChI=1S/C14H17N3O2/c1-14(4-5-15-8-14)17-13(19)9-2-3-11-10(6-9)7-12(18)16-11/h2-3,6,15H,4-5,7-8H2,1H3,(H,16,18)(H,17,19)
InChIKeyJWKGTCHBQPIIRT-UHFFFAOYSA-N
MW259.31 g/mol
LogP0.66
Rot. Bonds2

About N-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide

N-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide (PubChem CID 107422530) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide.

Molecular Properties

Compound NameN-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide
PubChem CID107422530
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide
SMILESCC1(NC(=O)c2ccc3c(c2)CC(=O)N3)CCNC1
InChIInChI=1S/C14H17N3O2/c1-14(4-5-15-8-14)17-13(19)9-2-3-11-10(6-9)7-12(18)16-11/h2-3,6,15H,4-5,7-8H2,1H3,(H,16,18)(H,17,19)
InChIKeyJWKGTCHBQPIIRT-UHFFFAOYSA-N
XLogP0.66
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 50.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylpiperidin-4-yl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 102711737
N-[1-(aminomethyl)cyclopentyl]-2-oxo-1,3-dihydroindole-5-carboxamide
CID 102711541
N-[3-(methylamino)propyl]-2-oxo-1,3-dihydroindole-5-carboxamide
CID 69247393
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-oxo-1,3-dihydroindole-5-carboxamide
CID 115271278
N-(2-ethyl-2-hydroxybutyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 103711840
N-(2-hydroxyethyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 18765684
methyl 2-[(2-oxo-1,3-dihydroindole-5-carbonyl)amino]acetate
CID 83724913
N-(2-hydroxypropyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 108784707
5-[4-methyl-4-(methylamino)piperidine-1-carbonyl]-1,3-dihydroindol-2-one
CID 102711671
N-(2-methyl-2-methylsulfanylpropyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 103713488
2-oxo-N-[(1-propan-2-ylcyclopropyl)methyl]-1,3-dihydroindole-5-carboxamide
CID 103742618
2-hydroxy-2-methyl-3-[(2-oxo-1,3-dihydroindole-5-carbonyl)amino]propanoic acid
CID 102710774

Frequently Asked Questions

What is the IUPAC name of N-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide?
The IUPAC name of N-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide (CID 107422530) is N-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide.
What is the SMILES notation for N-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide?
The canonical SMILES for N-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide is CC1(NC(=O)c2ccc3c(c2)CC(=O)N3)CCNC1.
What is the InChIKey of N-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide?
The InChIKey is JWKGTCHBQPIIRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-14(4-5-15-8-14)17-13(19)9-2-3-11-10(6-9)7-12(18)16-11/h2-3,6,15H,4-5,7-8H2,1H3,(H,16,18)(H,17,19).
What are the key properties of N-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide?
N-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 0.66, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylpyrrolidin-3-yl)-2-oxo-1,3-dihydroindole-5-carboxamide is sourced from PubChem (CID 107422530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).