N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide

C15H15N3O — CID 103713461

IUPACN-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide
SMILESCn1cccc1CNC(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C15H15N3O/c1-18-8-4-5-11(18)9-17-15(19)13-10-16-14-7-3-2-6-12(13)14/h2-8,10,16H,9H2,1H3,(H,17,19)
InChIKeySIVWIWHGGDWIPI-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.44
Rot. Bonds3

About N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide

N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide (PubChem CID 103713461) 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-3-carboxamide.

Molecular Properties

Compound NameN-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide
PubChem CID103713461
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC NameN-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide
SMILESCn1cccc1CNC(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C15H15N3O/c1-18-8-4-5-11(18)9-17-15(19)13-10-16-14-7-3-2-6-12(13)14/h2-8,10,16H,9H2,1H3,(H,17,19)
InChIKeySIVWIWHGGDWIPI-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

2-methyl-N-[(1-methylpyrrol-2-yl)methyl]benzamide
CID 110472049
N-[(1-methylpyrrol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide
CID 106422181
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1H-indole-3-carboxamide
CID 47363953
2-(dimethylamino)-N-[(1-methylpyrrol-2-yl)methyl]benzamide
CID 110473301
N-[(5-methylthiophen-2-yl)methyl]-1H-indole-3-carboxamide
CID 47381407
1-chloro-N-[(1-methylpyrrol-2-yl)methyl]isoquinoline-3-carboxamide
CID 103714433
N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-1H-indole-3-carboxamide
CID 115888739
methyl 2-(1H-indole-3-carbonylamino)acetate
CID 43406378
3-(1H-indol-3-yl)-2-[(1-methylpyrrol-2-yl)methylamino]propanamide
CID 177167804
N-(3-methyl-2-oxobutyl)-1H-indole-3-carboxamide
CID 59531603
N-[(4-cyanophenyl)methyl]-1H-indole-3-carboxamide
CID 60919239
2-(2-aminoethyl)-N-[(1-methylpyrrol-2-yl)methyl]benzamide
CID 106416688

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide?
The IUPAC name of N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide (CID 103713461) is N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide.
What is the SMILES notation for N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide?
The canonical SMILES for N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide is Cn1cccc1CNC(=O)c1c[nH]c2ccccc12.
What is the InChIKey of N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide?
The InChIKey is SIVWIWHGGDWIPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-18-8-4-5-11(18)9-17-15(19)13-10-16-14-7-3-2-6-12(13)14/h2-8,10,16H,9H2,1H3,(H,17,19).
What are the key properties of N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide?
N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-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-3-carboxamide is sourced from PubChem (CID 103713461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).