N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide

C15H15N3O — CID 103713378

IUPACN-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide
SMILESCn1cccc1CNC(=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C15H15N3O/c1-18-8-2-3-13(18)10-17-15(19)12-5-4-11-6-7-16-14(11)9-12/h2-9,16H,10H2,1H3,(H,17,19)
InChIKeyFKWIDYXHJAWWIU-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.44
Rot. Bonds3

About N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide

N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide (PubChem CID 103713378) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide
PubChem CID103713378
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC NameN-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide
SMILESCn1cccc1CNC(=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C15H15N3O/c1-18-8-2-3-13(18)10-17-15(19)12-5-4-11-6-7-16-14(11)9-12/h2-9,16H,10H2,1H3,(H,17,19)
InChIKeyFKWIDYXHJAWWIU-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-[(2-methyl-1,3-thiazol-4-yl)methyl]-1H-indole-6-carboxamide
CID 47290936
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-1H-indole-6-carboxamide
CID 79523236
N-[(2-fluorophenyl)methyl]-1H-indole-6-carboxamide
CID 39717434
N-[(5-methylpyrazin-2-yl)methyl]-1H-indole-6-carboxamide
CID 63770378
N-(3-methyl-2-propan-2-ylbutyl)-1H-indole-6-carboxamide
CID 102907607
N-(3-methylbut-2-enyl)-1H-indole-6-carboxamide
CID 103528166
3-[(1H-indole-6-carbonylamino)methyl]benzoic acid
CID 84761714
N-[(3-fluorophenyl)methyl]-1H-indole-6-carboxamide
CID 60764843
2-chloro-N-[(1-methylpyrrol-2-yl)methyl]-1,3-benzoxazole-5-carboxamide
CID 100787891
N-[2-(2-methoxyethylamino)ethyl]-1H-indole-6-carboxamide
CID 83040136
N-[2-(methanesulfonamido)ethyl]-1H-indole-6-carboxamide
CID 55028268

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide?
The IUPAC name of N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide (CID 103713378) is N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide.
What is the SMILES notation for N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide?
The canonical SMILES for N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide is Cn1cccc1CNC(=O)c1ccc2cc[nH]c2c1.
What is the InChIKey of N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide?
The InChIKey is FKWIDYXHJAWWIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-18-8-2-3-13(18)10-17-15(19)12-5-4-11-6-7-16-14(11)9-12/h2-9,16H,10H2,1H3,(H,17,19).
What are the key properties of N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide?
N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-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-2-yl)methyl]-1H-indole-6-carboxamide is sourced from PubChem (CID 103713378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).