N-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide

C15H19F2NO3 — CID 111331721

IUPACN-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide
SMILESO=C(CC1(O)CCCCC1)Nc1ccccc1OC(F)F
InChIInChI=1S/C15H19F2NO3/c16-14(17)21-12-7-3-2-6-11(12)18-13(19)10-15(20)8-4-1-5-9-15/h2-3,6-7,14,20H,1,4-5,8-10H2,(H,18,19)
InChIKeyCWZQHVWTERYYBL-UHFFFAOYSA-N
MW299.32 g/mol
LogP3.31
Rot. Bonds5

About N-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide

N-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide (PubChem CID 111331721) has the molecular formula C15H19F2NO3 and a molecular weight of 299.32 g/mol. Its IUPAC name is N-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide.

Molecular Properties

Compound NameN-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide
PubChem CID111331721
Molecular FormulaC15H19F2NO3
Molecular Weight299.32 g/mol
Exact Mass299.13
IUPAC NameN-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide
SMILESO=C(CC1(O)CCCCC1)Nc1ccccc1OC(F)F
InChIInChI=1S/C15H19F2NO3/c16-14(17)21-12-7-3-2-6-11(12)18-13(19)10-15(20)8-4-1-5-9-15/h2-3,6-7,14,20H,1,4-5,8-10H2,(H,18,19)
InChIKeyCWZQHVWTERYYBL-UHFFFAOYSA-N
XLogP3.31
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.32
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminocyclohexyl)-N-[2-(difluoromethoxy)phenyl]acetamide
CID 64684367
2-(1-hydroxycyclohexyl)-N-(2-methoxyphenyl)acetamide
CID 111331493
N-(2-ethoxyphenyl)-2-(1-hydroxycyclopentyl)acetamide
CID 111432228
N-[[2-(difluoromethoxy)phenyl]methyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111430390
N-[2-(difluoromethylsulfanyl)phenyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111432184
2-(1-hydroxycyclopentyl)-N-(2-hydroxyphenyl)acetamide
CID 111430337
N-[4-(difluoromethoxy)phenyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111430225
N-[2-(difluoromethoxy)phenyl]-2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 2622460
2-cyclohexyl-N-[2-(difluoromethoxy)phenyl]acetamide
CID 112793238
2-(1-hydroxycyclopentyl)-N-(2-methylsulfanylphenyl)acetamide
CID 111536466
N-[[2-(difluoromethoxy)-6-fluorophenyl]methyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111540945
N-(2,3-difluorophenyl)-2-(1-hydroxycyclohexyl)acetamide
CID 111537333

Frequently Asked Questions

What is the IUPAC name of N-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide?
The IUPAC name of N-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide (CID 111331721) is N-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide.
What is the SMILES notation for N-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide?
The canonical SMILES for N-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide is O=C(CC1(O)CCCCC1)Nc1ccccc1OC(F)F.
What is the InChIKey of N-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide?
The InChIKey is CWZQHVWTERYYBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F2NO3/c16-14(17)21-12-7-3-2-6-11(12)18-13(19)10-15(20)8-4-1-5-9-15/h2-3,6-7,14,20H,1,4-5,8-10H2,(H,18,19).
What are the key properties of N-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide?
N-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide has a molecular weight of 299.32 g/mol, XLogP of 3.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(difluoromethoxy)phenyl]-2-(1-hydroxycyclohexyl)acetamide is sourced from PubChem (CID 111331721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).