N-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide

C12H14FNO2 — CID 126774295

IUPACN-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide
SMILESCc1ccc(F)c(NC(=O)C2(O)CCC2)c1
InChIInChI=1S/C12H14FNO2/c1-8-3-4-9(13)10(7-8)14-11(15)12(16)5-2-6-12/h3-4,7,16H,2,5-6H2,1H3,(H,14,15)
InChIKeyCVEUXLAWBXYIDQ-UHFFFAOYSA-N
MW223.25 g/mol
LogP1.99
Rot. Bonds2

About N-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide

N-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide (PubChem CID 126774295) has the molecular formula C12H14FNO2 and a molecular weight of 223.25 g/mol. Its IUPAC name is N-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide.

Molecular Properties

Compound NameN-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide
PubChem CID126774295
Molecular FormulaC12H14FNO2
Molecular Weight223.25 g/mol
Exact Mass223.10
IUPAC NameN-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide
SMILESCc1ccc(F)c(NC(=O)C2(O)CCC2)c1
InChIInChI=1S/C12H14FNO2/c1-8-3-4-9(13)10(7-8)14-11(15)12(16)5-2-6-12/h3-4,7,16H,2,5-6H2,1H3,(H,14,15)
InChIKeyCVEUXLAWBXYIDQ-UHFFFAOYSA-N
XLogP1.99
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-fluoro-5-methylphenyl)-1-[(Z)-N'-hydroxycarbamimidoyl]cyclobutane-1-carboxamide
CID 80596684
N-(2-fluoro-5-methylphenyl)-1-(N'-hydroxycarbamimidoyl)cyclopentane-1-carboxamide
CID 76919645
N-(4-fluoro-2-methylphenyl)-1-hydroxycyclobutane-1-carboxamide
CID 126766616
N-(2-fluoro-5-methylphenyl)-1-[(Z)-N'-hydroxycarbamimidoyl]cyclopropane-1-carboxamide
CID 80596832
N-(2-fluoro-5-methylphenyl)pyrrolidine-1-carboxamide
CID 47032428
N-(5-chloro-2-fluorophenyl)-1-(4-fluorophenyl)cyclobutane-1-carboxamide
CID 134022500
N-(2-fluoro-5-methylphenyl)-4-methylbenzamide
CID 7718843
N-(2-fluoro-5-methylphenyl)-2-hydroxycyclopentane-1-carboxamide
CID 110013794
N-(2-fluoro-5-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 34749475
1-(2-fluoro-5-methylphenyl)-3-[[1-(hydroxymethyl)cyclopropyl]methyl]urea
CID 111572929
1-amino-N-(5-chloro-2-fluorophenyl)cyclopentane-1-carboxamide
CID 54925189
4-fluoro-3-[(1-methylcyclobutanecarbonyl)amino]benzoic acid
CID 120530218

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide?
The IUPAC name of N-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide (CID 126774295) is N-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide.
What is the SMILES notation for N-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide?
The canonical SMILES for N-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide is Cc1ccc(F)c(NC(=O)C2(O)CCC2)c1.
What is the InChIKey of N-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide?
The InChIKey is CVEUXLAWBXYIDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO2/c1-8-3-4-9(13)10(7-8)14-11(15)12(16)5-2-6-12/h3-4,7,16H,2,5-6H2,1H3,(H,14,15).
What are the key properties of N-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide?
N-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide has a molecular weight of 223.25 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methylphenyl)-1-hydroxycyclobutane-1-carboxamide is sourced from PubChem (CID 126774295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).