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

C15H19N3O — CID 47375273

IUPAC5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide
SMILESCc1ccc2[nH]c(C(=O)NC3CCN(C)C3)cc2c1
InChIInChI=1S/C15H19N3O/c1-10-3-4-13-11(7-10)8-14(17-13)15(19)16-12-5-6-18(2)9-12/h3-4,7-8,12,17H,5-6,9H2,1-2H3,(H,16,19)
InChIKeyCHOCWQJOADXJKB-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.91
Rot. Bonds2

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

5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide (PubChem CID 47375273) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide
PubChem CID47375273
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide
SMILESCc1ccc2[nH]c(C(=O)NC3CCN(C)C3)cc2c1
InChIInChI=1S/C15H19N3O/c1-10-3-4-13-11(7-10)8-14(17-13)15(19)16-12-5-6-18(2)9-12/h3-4,7-8,12,17H,5-6,9H2,1-2H3,(H,16,19)
InChIKeyCHOCWQJOADXJKB-UHFFFAOYSA-N
XLogP1.91
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide
CID 61344606
5-amino-N-(1-methylpiperidin-3-yl)-1H-indole-2-carboxamide
CID 63118303
N-cyclohexyl-5-methyl-1H-indole-2-carboxamide
CID 3886919
N-(1-methylpiperidin-3-yl)-1H-indole-2-carboxamide
CID 61212193
7-methyl-N-[(3S)-1-methylpyrrolidin-3-yl]-1H-indole-2-carboxamide
CID 44556339
N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-5-methyl-1H-indole-2-carboxamide
CID 11897305
N-cycloheptyl-6-methyl-1H-indole-2-carboxamide
CID 113207326
N-(4-hydroxycyclohexyl)-6-methyl-1H-indole-2-carboxamide
CID 110885323
[(9aS)-8-methyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl]-(5-methyl-1H-indol-2-yl)methanone
CID 98741991
(8-methyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)-(5-methyl-1H-indol-2-yl)methanone
CID 50958229
6-methyl-N-[1-[2-(6-oxopiperidin-3-yl)acetyl]pyrrolidin-3-yl]-1H-indole-2-carboxamide
CID 166389306
N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide
CID 89488958

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide?
The IUPAC name of 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide (CID 47375273) is 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide.
What is the SMILES notation for 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide?
The canonical SMILES for 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide is Cc1ccc2[nH]c(C(=O)NC3CCN(C)C3)cc2c1.
What is the InChIKey of 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide?
The InChIKey is CHOCWQJOADXJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-10-3-4-13-11(7-10)8-14(17-13)15(19)16-12-5-6-18(2)9-12/h3-4,7-8,12,17H,5-6,9H2,1-2H3,(H,16,19).
What are the key properties of 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide?
5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide has a molecular weight of 257.34 g/mol, XLogP of 1.91, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-indole-2-carboxamide is sourced from PubChem (CID 47375273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).