(2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate

C13H8ClF2NO2 — CID 4287006

IUPAC(2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate
SMILESO=C(Nc1cccc(F)c1)Oc1ccc(F)cc1Cl
InChIInChI=1S/C13H8ClF2NO2/c14-11-7-9(16)4-5-12(11)19-13(18)17-10-3-1-2-8(15)6-10/h1-7H,(H,17,18)
InChIKeyKIWMDYXYJFUHJP-UHFFFAOYSA-N
MW283.66 g/mol
LogP4.23
Rot. Bonds2

About (2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate

(2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate (PubChem CID 4287006) has the molecular formula C13H8ClF2NO2 and a molecular weight of 283.66 g/mol. Its IUPAC name is (2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate.

Molecular Properties

Compound Name(2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate
PubChem CID4287006
Molecular FormulaC13H8ClF2NO2
Molecular Weight283.66 g/mol
Exact Mass283.02
IUPAC Name(2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate
SMILESO=C(Nc1cccc(F)c1)Oc1ccc(F)cc1Cl
InChIInChI=1S/C13H8ClF2NO2/c14-11-7-9(16)4-5-12(11)19-13(18)17-10-3-1-2-8(15)6-10/h1-7H,(H,17,18)
InChIKeyKIWMDYXYJFUHJP-UHFFFAOYSA-N
XLogP4.23
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.66
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-chloro-4-fluorophenyl) N-[3-[2-(dimethylamino)acetyl]phenyl]carbamate
CID 170896293
N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide
CID 17172943
3,6-dichloro-N-(3-fluorophenyl)pyridine-2-carboxamide
CID 26719813
1-N-(3-chloro-4-methoxyphenyl)-2-N-(3-fluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109143261
1-[2-(2-chloro-4-fluorophenoxy)ethyl]-3-(3-chlorophenyl)urea
CID 112977061
1-(3-chloro-4-fluorophenyl)-3-(3-fluorophenyl)urea
CID 108893983
N-(3-chloro-4-methoxyphenyl)-6-(3-fluoroanilino)-2-methylpyrimidine-4-carboxamide
CID 112850391
3-chloropropyl N-(3-fluorophenyl)carbamate
CID 103970573
2-[3-chloro-4-(difluoromethoxy)anilino]-N-(3-fluorophenyl)acetamide
CID 9103360
1-[2-(2-chlorophenoxy)ethyl]-3-(3-fluorophenyl)urea
CID 112970688
N'-(4-chloro-2,5-dimethoxyphenyl)-N-(3-fluorophenyl)propanediamide
CID 108956608
9-chloro-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-N-(3-fluorophenyl)nonanamide
CID 4178133

Frequently Asked Questions

What is the IUPAC name of (2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate?
The IUPAC name of (2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate (CID 4287006) is (2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate.
What is the SMILES notation for (2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate?
The canonical SMILES for (2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate is O=C(Nc1cccc(F)c1)Oc1ccc(F)cc1Cl.
What is the InChIKey of (2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate?
The InChIKey is KIWMDYXYJFUHJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClF2NO2/c14-11-7-9(16)4-5-12(11)19-13(18)17-10-3-1-2-8(15)6-10/h1-7H,(H,17,18).
What are the key properties of (2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate?
(2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate has a molecular weight of 283.66 g/mol, XLogP of 4.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-4-fluorophenyl) N-(3-fluorophenyl)carbamate is sourced from PubChem (CID 4287006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).