N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide

C15H19N3O — CID 103707474

IUPACN-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide
SMILESCN1CCCC1CNC(=O)c1cccc2cc[nH]c12
InChIInChI=1S/C15H19N3O/c1-18-9-3-5-12(18)10-17-15(19)13-6-2-4-11-7-8-16-14(11)13/h2,4,6-8,12,16H,3,5,9-10H2,1H3,(H,17,19)
InChIKeyQGAGQIRZIZFWDK-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.99
Rot. Bonds3

About N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide

N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide (PubChem CID 103707474) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide.

Molecular Properties

Compound NameN-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide
PubChem CID103707474
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide
SMILESCN1CCCC1CNC(=O)c1cccc2cc[nH]c12
InChIInChI=1S/C15H19N3O/c1-18-9-3-5-12(18)10-17-15(19)13-6-2-4-11-7-8-16-14(11)13/h2,4,6-8,12,16H,3,5,9-10H2,1H3,(H,17,19)
InChIKeyQGAGQIRZIZFWDK-UHFFFAOYSA-N
XLogP1.99
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-3-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]benzamide
CID 114137909
N-(pyrrolidin-3-ylmethyl)-1H-indole-7-carboxamide
CID 80564493
2-methoxy-N-[(1-methylpyrrolidin-2-yl)methyl]benzamide
CID 47416436
N-(2-cyclobutylethyl)-1H-indole-7-carboxamide
CID 115687252
N-(2-pyrrolidin-1-ylpropyl)-1H-indole-7-carboxamide
CID 79035908
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-1H-indole-7-carboxamide
CID 103800511
N-[[(3S)-1-(pyridin-3-ylmethyl)piperidin-3-yl]methyl]-1H-indole-7-carboxamide
CID 96563164
2-fluoro-3-methyl-N-[(1-methylpiperidin-2-yl)methyl]benzamide
CID 81480197
2-hydroxy-N-[(1-methylpyrrolidin-2-yl)methyl]-3-nitrobenzamide
CID 103800126
N-(3-cyclopentylpropyl)-1H-indole-7-carboxamide
CID 103706667
3-(methylamino)-N-[(1-methylpyrrolidin-2-yl)methyl]pyridine-4-carboxamide
CID 114138605
N-[[(2S,3S)-1-methyl-5-oxo-2-phenylpyrrolidin-3-yl]methyl]-1H-indole-7-carboxamide
CID 97347224

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide?
The IUPAC name of N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide (CID 103707474) is N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide.
What is the SMILES notation for N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide?
The canonical SMILES for N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide is CN1CCCC1CNC(=O)c1cccc2cc[nH]c12.
What is the InChIKey of N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide?
The InChIKey is QGAGQIRZIZFWDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-18-9-3-5-12(18)10-17-15(19)13-6-2-4-11-7-8-16-14(11)13/h2,4,6-8,12,16H,3,5,9-10H2,1H3,(H,17,19).
What are the key properties of N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide?
N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide has a molecular weight of 257.34 g/mol, XLogP of 1.99, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide is sourced from PubChem (CID 103707474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).