3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide

C19H28FNO2 — CID 90599087

IUPAC3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide
SMILESCOC(C)(CNC(=O)CCC1CCCCC1)c1ccccc1F
InChIInChI=1S/C19H28FNO2/c1-19(23-2,16-10-6-7-11-17(16)20)14-21-18(22)13-12-15-8-4-3-5-9-15/h6-7,10-11,15H,3-5,8-9,12-14H2,1-2H3,(H,21,22)
InChIKeyUIEBINBDYQHNJR-UHFFFAOYSA-N
MW321.44 g/mol
LogP4.16
Rot. Bonds7

About 3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide

3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide (PubChem CID 90599087) has the molecular formula C19H28FNO2 and a molecular weight of 321.44 g/mol. Its IUPAC name is 3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide.

Molecular Properties

Compound Name3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide
PubChem CID90599087
Molecular FormulaC19H28FNO2
Molecular Weight321.44 g/mol
Exact Mass321.21
IUPAC Name3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide
SMILESCOC(C)(CNC(=O)CCC1CCCCC1)c1ccccc1F
InChIInChI=1S/C19H28FNO2/c1-19(23-2,16-10-6-7-11-17(16)20)14-21-18(22)13-12-15-8-4-3-5-9-15/h6-7,10-11,15H,3-5,8-9,12-14H2,1-2H3,(H,21,22)
InChIKeyUIEBINBDYQHNJR-UHFFFAOYSA-N
XLogP4.16
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.44
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]acetamide
CID 90599072
N-[2-(3-chlorophenyl)-2-methoxypropyl]-3-cyclohexylpropanamide
CID 90599865
N-[2-(2-fluorophenyl)-2-methoxypropyl]-3-(4-methoxyphenyl)propanamide
CID 71810627
N-[(2S)-2-(2-fluorophenyl)-2-methoxypropyl]-3-[4-(trifluoromethyl)phenyl]propanamide
CID 97428425
2-(2,5-dioxopyrrolidin-1-yl)-N-[(2S)-2-(2-fluorophenyl)-2-methoxypropyl]acetamide
CID 97428333
N-[2-(2-fluorophenyl)-2-methoxypropyl]-N'-propan-2-yloxamide
CID 90599312
2-(3,4-dimethoxyphenyl)-N-[2-(2-fluorophenyl)-2-methoxypropyl]acetamide
CID 90599157
ethyl N-[2-(2-fluorophenyl)-2-methoxypropyl]carbamate
CID 71810594
4-fluoro-N-[2-(2-fluorophenyl)-2-methoxypropyl]benzamide
CID 90599067
3-cyclopentyl-N-(2-fluorophenyl)propanamide
CID 917347
2-chloro-N-[(2S)-2-(2-fluorophenyl)-2-methoxypropyl]benzamide
CID 97428331
N-(2-amino-2-methylpropyl)-3-cyclopentylpropanamide
CID 81425234

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide?
The IUPAC name of 3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide (CID 90599087) is 3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide.
What is the SMILES notation for 3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide?
The canonical SMILES for 3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide is COC(C)(CNC(=O)CCC1CCCCC1)c1ccccc1F.
What is the InChIKey of 3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide?
The InChIKey is UIEBINBDYQHNJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28FNO2/c1-19(23-2,16-10-6-7-11-17(16)20)14-21-18(22)13-12-15-8-4-3-5-9-15/h6-7,10-11,15H,3-5,8-9,12-14H2,1-2H3,(H,21,22).
What are the key properties of 3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide?
3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide has a molecular weight of 321.44 g/mol, XLogP of 4.16, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-[2-(2-fluorophenyl)-2-methoxypropyl]propanamide is sourced from PubChem (CID 90599087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).