N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide

C21H20FNO2 — CID 90599111

IUPACN-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide
SMILESCOC(C)(CNC(=O)c1cccc2ccccc12)c1ccccc1F
InChIInChI=1S/C21H20FNO2/c1-21(25-2,18-12-5-6-13-19(18)22)14-23-20(24)17-11-7-9-15-8-3-4-10-16(15)17/h3-13H,14H2,1-2H3,(H,23,24)
InChIKeySKZFIPJALAMEMW-UHFFFAOYSA-N
MW337.39 g/mol
LogP4.27
Rot. Bonds5

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

N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide (PubChem CID 90599111) has the molecular formula C21H20FNO2 and a molecular weight of 337.39 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide
PubChem CID90599111
Molecular FormulaC21H20FNO2
Molecular Weight337.39 g/mol
Exact Mass337.15
IUPAC NameN-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide
SMILESCOC(C)(CNC(=O)c1cccc2ccccc12)c1ccccc1F
InChIInChI=1S/C21H20FNO2/c1-21(25-2,18-12-5-6-13-19(18)22)14-23-20(24)17-11-7-9-15-8-3-4-10-16(15)17/h3-13H,14H2,1-2H3,(H,23,24)
InChIKeySKZFIPJALAMEMW-UHFFFAOYSA-N
XLogP4.27
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.39
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-[(2S)-2-(2-fluorophenyl)-2-methoxypropyl]benzamide
CID 97428331
4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide
CID 90599067
N-[2-(2-fluorophenyl)-2-methoxypropyl]-1H-indole-2-carboxamide
CID 90599092
N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide
CID 90599093
N-[2-(2-fluorophenyl)-2-methoxypropyl]-4-(trifluoromethyl)benzamide
CID 90599146
N-benzyl-N'-[(2S)-2-(2-fluorophenyl)-2-methoxypropyl]oxamide
CID 97428501
N-[(2S)-2-(2-fluorophenyl)-2-methoxypropyl]-7-methoxy-1-benzofuran-2-carboxamide
CID 97428375
ethyl N-[2-(2-fluorophenyl)-2-methoxypropyl]carbamate
CID 71810594
N-[2-(2-fluorophenyl)-2-methoxypropyl]-4-oxochromene-2-carboxamide
CID 90599147
1-[(2S)-2-(2-fluorophenyl)-2-methoxypropyl]-3-[(4-fluorophenyl)methyl]urea
CID 97428533
N-[2-(2-fluorophenyl)-2-methoxypropyl]-N'-propan-2-yloxamide
CID 90599312
2-ethoxy-N-[(2S)-2-(2-fluorophenyl)-2-methoxypropyl]acetamide
CID 97428304

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide (CID 90599111) is N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide is COC(C)(CNC(=O)c1cccc2ccccc12)c1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide?
The InChIKey is SKZFIPJALAMEMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FNO2/c1-21(25-2,18-12-5-6-13-19(18)22)14-23-20(24)17-11-7-9-15-8-3-4-10-16(15)17/h3-13H,14H2,1-2H3,(H,23,24).
What are the key properties of N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide?
N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide has a molecular weight of 337.39 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)-2-methoxypropyl]naphthalene-1-carboxamide is sourced from PubChem (CID 90599111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).