N-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide

C19H20ClNO2 — CID 18279329

IUPACN-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide
SMILESO=C(Nc1ccccc1Oc1ccccc1Cl)C1CCCCC1
InChIInChI=1S/C19H20ClNO2/c20-15-10-4-6-12-17(15)23-18-13-7-5-11-16(18)21-19(22)14-8-2-1-3-9-14/h4-7,10-14H,1-3,8-9H2,(H,21,22)
InChIKeyNUKHFFUGBCSXKM-UHFFFAOYSA-N
MW329.83 g/mol
LogP5.65
Rot. Bonds4

About N-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide

N-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide (PubChem CID 18279329) has the molecular formula C19H20ClNO2 and a molecular weight of 329.83 g/mol. Its IUPAC name is N-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide
PubChem CID18279329
Molecular FormulaC19H20ClNO2
Molecular Weight329.83 g/mol
Exact Mass329.12
IUPAC NameN-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide
SMILESO=C(Nc1ccccc1Oc1ccccc1Cl)C1CCCCC1
InChIInChI=1S/C19H20ClNO2/c20-15-10-4-6-12-17(15)23-18-13-7-5-11-16(18)21-19(22)14-8-2-1-3-9-14/h4-7,10-14H,1-3,8-9H2,(H,21,22)
InChIKeyNUKHFFUGBCSXKM-UHFFFAOYSA-N
XLogP5.65
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.83
LogP ≤ 55.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-chlorophenoxy)phenyl]-1-cyclopentyl-5-oxopyrrolidine-3-carboxamide
CID 24514336
N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide
CID 837694
N-(2,3-dichlorophenyl)cyclohexanecarboxamide
CID 836509
N-[2-(2-chlorophenoxy)phenyl]-3-(cyclopropanecarbonylamino)benzamide
CID 31801212
4-N-(2-chlorophenyl)-1-N-(2-methoxyphenyl)cyclohexane-1,4-dicarboxamide
CID 109150938
N-(2-chlorophenyl)cyclopropanecarboxamide
CID 849222
N-[2-(2-chlorophenoxy)phenyl]bicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 154750697
(2S,5R)-5-(aminomethyl)-N-[2-(2-chlorophenoxy)phenyl]oxolane-2-carboxamide;hydrochloride
CID 120784929
1-benzyl-N-[2-(2-chlorophenoxy)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 24514266
N-[2-(chloromethyl)phenyl]cyclohexanecarboxamide
CID 114298121
3-[2-(2-chlorophenoxy)phenyl]-1,1-dimethylurea
CID 19858561
N-(2,6-dichlorophenyl)cyclohexanecarboxamide
CID 897145

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide (CID 18279329) is N-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide is O=C(Nc1ccccc1Oc1ccccc1Cl)C1CCCCC1.
What is the InChIKey of N-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide?
The InChIKey is NUKHFFUGBCSXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClNO2/c20-15-10-4-6-12-17(15)23-18-13-7-5-11-16(18)21-19(22)14-8-2-1-3-9-14/h4-7,10-14H,1-3,8-9H2,(H,21,22).
What are the key properties of N-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide?
N-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide has a molecular weight of 329.83 g/mol, XLogP of 5.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-chlorophenoxy)phenyl]cyclohexanecarboxamide is sourced from PubChem (CID 18279329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).