N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide

C19H19FN2O2 — CID 90599092

IUPACN-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide
SMILESCOC(C)(CNC(=O)c1cc2ccccc2[nH]1)c1ccccc1F
InChIInChI=1S/C19H19FN2O2/c1-19(24-2,14-8-4-5-9-15(14)20)12-21-18(23)17-11-13-7-3-6-10-16(13)22-17/h3-11,22H,12H2,1-2H3,(H,21,23)
InChIKeyJVIVLCGLRALHEU-UHFFFAOYSA-N
MW326.37 g/mol
LogP3.60
Rot. Bonds5

About N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide

N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide (PubChem CID 90599092) has the molecular formula C19H19FN2O2 and a molecular weight of 326.37 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide
PubChem CID90599092
Molecular FormulaC19H19FN2O2
Molecular Weight326.37 g/mol
Exact Mass326.14
IUPAC NameN-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide
SMILESCOC(C)(CNC(=O)c1cc2ccccc2[nH]1)c1ccccc1F
InChIInChI=1S/C19H19FN2O2/c1-19(24-2,14-8-4-5-9-15(14)20)12-21-18(23)17-11-13-7-3-6-10-16(13)22-17/h3-11,22H,12H2,1-2H3,(H,21,23)
InChIKeyJVIVLCGLRALHEU-UHFFFAOYSA-N
XLogP3.60
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.37
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-fluorophenyl)-2-methoxypropyl]-6-methoxy-1H-indole-2-carboxamide
CID 90599204
N-[2-(3-chlorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide
CID 90599873
4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide
CID 90599067
N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide
CID 90599111
N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide
CID 90599093
N-[(2-fluorophenyl)methyl]-1H-indole-2-carboxamide
CID 9374796
3-(1H-indole-2-carbonylamino)-2,2-dimethylpropanoic acid
CID 81370075
2-chloro-N-[(2S)-2-(2-fluorophenyl)-2-methoxypropyl]benzamide
CID 97428331
N-[2-(2-fluorophenyl)-2-methoxypropyl]-4-(trifluoromethyl)benzamide
CID 90599146
N-[(2S)-2-hydroxy-2-methyl-3-methylsulfanylpropyl]-1H-indole-2-carboxamide
CID 95773944
methyl 6-(1H-indole-2-carbonylamino)hexanoate
CID 43407298
2-(3,4-dimethoxyphenyl)-N-[2-(2-fluorophenyl)-2-methoxypropyl]acetamide
CID 90599157

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide (CID 90599092) is N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide is COC(C)(CNC(=O)c1cc2ccccc2[nH]1)c1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide?
The InChIKey is JVIVLCGLRALHEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O2/c1-19(24-2,14-8-4-5-9-15(14)20)12-21-18(23)17-11-13-7-3-6-10-16(13)22-17/h3-11,22H,12H2,1-2H3,(H,21,23).
What are the key properties of N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide?
N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide has a molecular weight of 326.37 g/mol, XLogP of 3.60, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 90599092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).