N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide

C14H15N3O2 — CID 110474030

IUPACN-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide
SMILESCN1CC(NC(=O)c2cc3ccccc3[nH]2)CC1=O
InChIInChI=1S/C14H15N3O2/c1-17-8-10(7-13(17)18)15-14(19)12-6-9-4-2-3-5-11(9)16-12/h2-6,10,16H,7-8H2,1H3,(H,15,19)
InChIKeySDNBGRUFMBUWCX-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.13
Rot. Bonds2

About N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide

N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide (PubChem CID 110474030) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide
PubChem CID110474030
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide
SMILESCN1CC(NC(=O)c2cc3ccccc3[nH]2)CC1=O
InChIInChI=1S/C14H15N3O2/c1-17-8-10(7-13(17)18)15-14(19)12-6-9-4-2-3-5-11(9)16-12/h2-6,10,16H,7-8H2,1H3,(H,15,19)
InChIKeySDNBGRUFMBUWCX-UHFFFAOYSA-N
XLogP1.13
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide?
The IUPAC name of N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide (CID 110474030) is N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide?
The canonical SMILES for N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide is CN1CC(NC(=O)c2cc3ccccc3[nH]2)CC1=O.
What is the InChIKey of N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide?
The InChIKey is SDNBGRUFMBUWCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-17-8-10(7-13(17)18)15-14(19)12-6-9-4-2-3-5-11(9)16-12/h2-6,10,16H,7-8H2,1H3,(H,15,19).
What are the key properties of N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide?
N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.13, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide is sourced from PubChem (CID 110474030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).