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

C15H15N3O — CID 103713426

IUPACN-[(1-methylpyrrol-2-yl)methyl]-1H-indole-7-carboxamide
SMILESCn1cccc1CNC(=O)c1cccc2cc[nH]c12
InChIInChI=1S/C15H15N3O/c1-18-9-3-5-12(18)10-17-15(19)13-6-2-4-11-7-8-16-14(11)13/h2-9,16H,10H2,1H3,(H,17,19)
InChIKeyVXNDVPSKUFPZMY-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.44
Rot. Bonds3

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

N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-7-carboxamide (PubChem CID 103713426) 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-7-carboxamide.

Molecular Properties

Compound NameN-[(1-methylpyrrol-2-yl)methyl]-1H-indole-7-carboxamide
PubChem CID103713426
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC NameN-[(1-methylpyrrol-2-yl)methyl]-1H-indole-7-carboxamide
SMILESCn1cccc1CNC(=O)c1cccc2cc[nH]c12
InChIInChI=1S/C15H15N3O/c1-18-9-3-5-12(18)10-17-15(19)13-6-2-4-11-7-8-16-14(11)13/h2-9,16H,10H2,1H3,(H,17,19)
InChIKeyVXNDVPSKUFPZMY-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-3-yl)methyl]-1H-indole-7-carboxamide
CID 103722337
2-hydroxy-N-[(1-methylpyrrol-2-yl)methyl]benzamide
CID 103713795
N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-6-carboxamide
CID 103713378
2-methyl-N-[(1-methylpyrrol-2-yl)methyl]benzamide
CID 110472049
N-(furan-3-ylmethyl)-1H-indole-7-carboxamide
CID 115659835
N-[(1-methylpyrrol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide
CID 106422181
N-[(2S)-2-hydroxypropyl]-1H-indole-7-carboxamide
CID 83030773
2-(dimethylamino)-N-[(1-methylpyrrol-2-yl)methyl]benzamide
CID 110473301
N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-3-carboxamide
CID 103713461
N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-1H-indole-7-carboxamide
CID 103706853
2-bromo-N-[(1-methylpyrrol-2-yl)methyl]pyridine-3-carboxamide
CID 103755664
N-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole-7-carboxamide
CID 103707474

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-7-carboxamide?
The IUPAC name of N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-7-carboxamide (CID 103713426) is N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-7-carboxamide.
What is the SMILES notation for N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-7-carboxamide?
The canonical SMILES for N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-7-carboxamide is Cn1cccc1CNC(=O)c1cccc2cc[nH]c12.
What is the InChIKey of N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-7-carboxamide?
The InChIKey is VXNDVPSKUFPZMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-18-9-3-5-12(18)10-17-15(19)13-6-2-4-11-7-8-16-14(11)13/h2-9,16H,10H2,1H3,(H,17,19).
What are the key properties of N-[(1-methylpyrrol-2-yl)methyl]-1H-indole-7-carboxamide?
N-[(1-methylpyrrol-2-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-2-yl)methyl]-1H-indole-7-carboxamide is sourced from PubChem (CID 103713426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).