2-[1-(3-fluorophenyl)cyclobutyl]acetamide

C12H14FNO — CID 121344932

IUPAC2-[1-(3-fluorophenyl)cyclobutyl]acetamide
SMILESNC(=O)CC1(c2cccc(F)c2)CCC1
InChIInChI=1S/C12H14FNO/c13-10-4-1-3-9(7-10)12(5-2-6-12)8-11(14)15/h1,3-4,7H,2,5-6,8H2,(H2,14,15)
InChIKeyXCQVQNNXMKLEBI-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.12
Rot. Bonds3

About 2-[1-(3-fluorophenyl)cyclobutyl]acetamide

2-[1-(3-fluorophenyl)cyclobutyl]acetamide (PubChem CID 121344932) has the molecular formula C12H14FNO and a molecular weight of 207.25 g/mol. Its IUPAC name is 2-[1-(3-fluorophenyl)cyclobutyl]acetamide.

Molecular Properties

Compound Name2-[1-(3-fluorophenyl)cyclobutyl]acetamide
PubChem CID121344932
Molecular FormulaC12H14FNO
Molecular Weight207.25 g/mol
Exact Mass207.11
IUPAC Name2-[1-(3-fluorophenyl)cyclobutyl]acetamide
SMILESNC(=O)CC1(c2cccc(F)c2)CCC1
InChIInChI=1S/C12H14FNO/c13-10-4-1-3-9(7-10)12(5-2-6-12)8-11(14)15/h1,3-4,7H,2,5-6,8H2,(H2,14,15)
InChIKeyXCQVQNNXMKLEBI-UHFFFAOYSA-N
XLogP2.12
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-fluoro-3-[1-(isocyanomethyl)cyclobutyl]benzene
CID 105443630
(2-amino-2-oxoethyl) 1-(3-fluorophenyl)cyclopentane-1-carboxylate
CID 16526221
1-amino-N-[[1-(3-fluorophenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119332781
2-[3-(3-fluorophenyl)oxolan-3-yl]acetic acid
CID 83823159
2-[2-(3-fluorophenyl)azetidin-2-yl]acetic acid
CID 115059052
1-[1-(3-fluorophenyl)cyclohexyl]-N,N-dimethylmethanamine
CID 53321082
2-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetic acid
CID 66748836
N-[2-(2-amino-2-oxoethoxy)ethyl]-1-(3-fluorophenyl)cyclobutane-1-carboxamide
CID 75381149
[3-[1-(3-fluorophenyl)cyclopentanecarbonyl]oxy-2-oxopropyl] 1-(3-fluorophenyl)cyclopentane-1-carboxylate
CID 3976420
1-(3-fluorophenyl)-N-[(1-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide
CID 111445692
(2R)-2-amino-N-[[1-(3-fluorophenyl)cyclopropyl]methyl]propanamide;hydrochloride
CID 119332783
1-carbamoyl-3-[1-(3-fluorophenyl)cyclopentyl]urea
CID 110469918

Frequently Asked Questions

What is the IUPAC name of 2-[1-(3-fluorophenyl)cyclobutyl]acetamide?
The IUPAC name of 2-[1-(3-fluorophenyl)cyclobutyl]acetamide (CID 121344932) is 2-[1-(3-fluorophenyl)cyclobutyl]acetamide.
What is the SMILES notation for 2-[1-(3-fluorophenyl)cyclobutyl]acetamide?
The canonical SMILES for 2-[1-(3-fluorophenyl)cyclobutyl]acetamide is NC(=O)CC1(c2cccc(F)c2)CCC1.
What is the InChIKey of 2-[1-(3-fluorophenyl)cyclobutyl]acetamide?
The InChIKey is XCQVQNNXMKLEBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO/c13-10-4-1-3-9(7-10)12(5-2-6-12)8-11(14)15/h1,3-4,7H,2,5-6,8H2,(H2,14,15).
What are the key properties of 2-[1-(3-fluorophenyl)cyclobutyl]acetamide?
2-[1-(3-fluorophenyl)cyclobutyl]acetamide has a molecular weight of 207.25 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(3-fluorophenyl)cyclobutyl]acetamide is sourced from PubChem (CID 121344932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).