N-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide

C16H14N2O2 — CID 63748080

IUPACN-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide
SMILESO=C(Nc1ccccc1CO)c1ccc2cc[nH]c2c1
InChIInChI=1S/C16H14N2O2/c19-10-13-3-1-2-4-14(13)18-16(20)12-6-5-11-7-8-17-15(11)9-12/h1-9,17,19H,10H2,(H,18,20)
InChIKeyJYVWTBWGLJLCTG-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.91
Rot. Bonds3

About N-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide

N-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide (PubChem CID 63748080) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is N-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide
PubChem CID63748080
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC NameN-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide
SMILESO=C(Nc1ccccc1CO)c1ccc2cc[nH]c2c1
InChIInChI=1S/C16H14N2O2/c19-10-13-3-1-2-4-14(13)18-16(20)12-6-5-11-7-8-17-15(11)9-12/h1-9,17,19H,10H2,(H,18,20)
InChIKeyJYVWTBWGLJLCTG-UHFFFAOYSA-N
XLogP2.91
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-propylphenyl)-1H-indole-5-carboxamide
CID 63717145
3,4-difluoro-N-[2-(hydroxymethyl)phenyl]benzamide
CID 61498076
N-(2-cyanophenyl)-1H-indole-5-carboxamide
CID 63770547
N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide
CID 60773719
N-[(2-fluorophenyl)methyl]-1H-indole-6-carboxamide
CID 39717434
1-(2-ethylphenyl)-3-(1H-indol-6-yl)urea
CID 17181458
N-[2-(chloromethyl)phenyl]naphthalene-2-carboxamide
CID 114298463
3-fluoro-N-[2-(hydroxymethyl)phenyl]-4-methylbenzamide
CID 60682262
N-(2-bromo-4-chlorophenyl)-1H-indole-6-carboxamide
CID 81024878
4-[2-(1H-indole-5-carbonylamino)phenoxy]butanoic acid
CID 139632495
N-(3-methyl-4-pyridinyl)-1H-indole-6-carboxamide
CID 63709047
N-(4-methyl-3-pyridinyl)-1H-indole-6-carboxamide
CID 55225910

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide?
The IUPAC name of N-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide (CID 63748080) is N-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide.
What is the SMILES notation for N-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide?
The canonical SMILES for N-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide is O=C(Nc1ccccc1CO)c1ccc2cc[nH]c2c1.
What is the InChIKey of N-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide?
The InChIKey is JYVWTBWGLJLCTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c19-10-13-3-1-2-4-14(13)18-16(20)12-6-5-11-7-8-17-15(11)9-12/h1-9,17,19H,10H2,(H,18,20).
What are the key properties of N-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide?
N-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 2.91, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethyl)phenyl]-1H-indole-6-carboxamide is sourced from PubChem (CID 63748080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).