N-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide

C16H16N2O2 — CID 114332238

IUPACN-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide
SMILESO=C(NCc1ccc(O)cc1)c1ccc2c(c1)NCC2
InChIInChI=1S/C16H16N2O2/c19-14-5-1-11(2-6-14)10-18-16(20)13-4-3-12-7-8-17-15(12)9-13/h1-6,9,17,19H,7-8,10H2,(H,18,20)
InChIKeyNCCRNYBLQDJZGY-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.29
Rot. Bonds3

About N-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide

N-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide (PubChem CID 114332238) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide
PubChem CID114332238
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC NameN-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide
SMILESO=C(NCc1ccc(O)cc1)c1ccc2c(c1)NCC2
InChIInChI=1S/C16H16N2O2/c19-14-5-1-11(2-6-14)10-18-16(20)13-4-3-12-7-8-17-15(12)9-13/h1-6,9,17,19H,7-8,10H2,(H,18,20)
InChIKeyNCCRNYBLQDJZGY-UHFFFAOYSA-N
XLogP2.29
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104614366
N-(2-methoxy-2-methylpropyl)-2,3-dihydro-1H-indole-6-carboxamide
CID 104761349
N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-2,3-dihydro-1H-indole-6-carboxamide
CID 106276798
N-cyclopentyl-2,3-dihydro-1H-indole-6-carboxamide
CID 113382512
N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-2,3-dihydro-1H-indole-6-carboxamide
CID 106416306
3-bromo-N-[(4-hydroxyphenyl)methyl]-4-methylbenzamide
CID 115671047
3-chloro-4-fluoro-N-[(4-hydroxyphenyl)methyl]benzamide
CID 115731912
N-(3-benzamidophenyl)-2,3-dihydro-1H-indole-6-carboxamide
CID 143229213
N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide
CID 113467223
4-tert-butyl-N-[(4-hydroxyphenyl)methyl]benzamide
CID 115577854
N-[(4-hydroxyphenyl)methyl]-6-oxo-1H-pyridine-3-carboxamide
CID 115577610
N-[(4-hydroxyphenyl)methyl]-3H-benzimidazole-5-carboxamide
CID 110473116

Frequently Asked Questions

What is the IUPAC name of N-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide?
The IUPAC name of N-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide (CID 114332238) is N-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide.
What is the SMILES notation for N-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide?
The canonical SMILES for N-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide is O=C(NCc1ccc(O)cc1)c1ccc2c(c1)NCC2.
What is the InChIKey of N-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide?
The InChIKey is NCCRNYBLQDJZGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c19-14-5-1-11(2-6-14)10-18-16(20)13-4-3-12-7-8-17-15(12)9-13/h1-6,9,17,19H,7-8,10H2,(H,18,20).
What are the key properties of N-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide?
N-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide has a molecular weight of 268.32 g/mol, XLogP of 2.29, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-hydroxyphenyl)methyl]-2,3-dihydro-1H-indole-6-carboxamide is sourced from PubChem (CID 114332238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).