N-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide

C15H15N3O — CID 103722337

IUPACN-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide
SMILESCn1ccc(CNC(=O)c2cccc3cc[nH]c23)c1
InChIInChI=1S/C15H15N3O/c1-18-8-6-11(10-18)9-17-15(19)13-4-2-3-12-5-7-16-14(12)13/h2-8,10,16H,9H2,1H3,(H,17,19)
InChIKeyBLJVRMZFNCYCSB-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.44
Rot. Bonds3

About N-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide

N-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide (PubChem CID 103722337) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is N-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide.

Molecular Properties

Compound NameN-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide
PubChem CID103722337
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC NameN-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide
SMILESCn1ccc(CNC(=O)c2cccc3cc[nH]c23)c1
InChIInChI=1S/C15H15N3O/c1-18-8-6-11(10-18)9-17-15(19)13-4-2-3-12-5-7-16-14(12)13/h2-8,10,16H,9H2,1H3,(H,17,19)
InChIKeyBLJVRMZFNCYCSB-UHFFFAOYSA-N
XLogP2.44
TPSA49.82 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-7-carboxamide
CID 103713426
N-(furan-3-ylmethyl)-1H-indole-7-carboxamide
CID 115659835
2-hydroxy-3-methoxy-N-[(1-methylpyrrol-3-yl)methyl]benzamide
CID 103721972
N-[(2S)-2-hydroxypropyl]-1H-indole-7-carboxamide
CID 83030773
6-methyl-N-[(1-methylpyrrol-3-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide
CID 103722339
N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-1H-indole-7-carboxamide
CID 103706853
N-[(2-ethyl-4-methyl-1,3-thiazol-5-yl)methyl]-1H-indole-7-carboxamide
CID 122570183
N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide
CID 103707474
2-bromo-N-[(1-methylpyrrol-3-yl)methyl]-3-nitrobenzamide
CID 106547494
N-(1,2,4-oxadiazol-3-ylmethyl)-1H-indole-7-carboxamide
CID 106406322
3-[(1H-indole-7-carbonylamino)methyl]pentanoic acid
CID 81066304
N-(2-hydroxy-2,3-dimethylbutyl)-1H-indole-7-carboxamide
CID 111483563

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide?
The IUPAC name of N-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide (CID 103722337) is N-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide.
What is the SMILES notation for N-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide?
The canonical SMILES for N-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide is Cn1ccc(CNC(=O)c2cccc3cc[nH]c23)c1.
What is the InChIKey of N-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide?
The InChIKey is BLJVRMZFNCYCSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-18-8-6-11(10-18)9-17-15(19)13-4-2-3-12-5-7-16-14(12)13/h2-8,10,16H,9H2,1H3,(H,17,19).
What are the key properties of N-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide?
N-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide has a molecular weight of 253.31 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpyrrol-3-yl)methyl]-1H-indole-7-carboxamide is sourced from PubChem (CID 103722337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).