3-chloro-N-cyclohexyl-N-ethylbenzamide

C15H20ClNO — CID 587324

IUPAC3-chloro-N-cyclohexyl-N-ethylbenzamide
SMILESCCN(C(=O)c1cccc(Cl)c1)C1CCCCC1
InChIInChI=1S/C15H20ClNO/c1-2-17(14-9-4-3-5-10-14)15(18)12-7-6-8-13(16)11-12/h6-8,11,14H,2-5,9-10H2,1H3
InChIKeyDVILLGOZMSCQDF-UHFFFAOYSA-N
MW265.78 g/mol
LogP4.13
Rot. Bonds3

About 3-chloro-N-cyclohexyl-N-ethylbenzamide

3-chloro-N-cyclohexyl-N-ethylbenzamide (PubChem CID 587324) has the molecular formula C15H20ClNO and a molecular weight of 265.78 g/mol. Its IUPAC name is 3-chloro-N-cyclohexyl-N-ethylbenzamide.

Molecular Properties

Compound Name3-chloro-N-cyclohexyl-N-ethylbenzamide
PubChem CID587324
Molecular FormulaC15H20ClNO
Molecular Weight265.78 g/mol
Exact Mass265.12
IUPAC Name3-chloro-N-cyclohexyl-N-ethylbenzamide
SMILESCCN(C(=O)c1cccc(Cl)c1)C1CCCCC1
InChIInChI=1S/C15H20ClNO/c1-2-17(14-9-4-3-5-10-14)15(18)12-7-6-8-13(16)11-12/h6-8,11,14H,2-5,9-10H2,1H3
InChIKeyDVILLGOZMSCQDF-UHFFFAOYSA-N
XLogP4.13
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.78
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

U-47700
CID 71719125
N-benzyl-4-chloro-N-cyclohexylbenzamide
CID 24752728
N-butyl-2-chlorobenzamide
CID 347041
2-Chloro-N-phenethyl-benzamide
CID 692233
Jnj-63533054
CID 2548547
4-Chloro-N-phenethylbenzamide
CID 306479
N-benzyl-4-chlorobenzamide
CID 346668
N-[(4-chlorophenyl)methyl]-4-ethylbenzamide
CID 2097068
1-Benzyl-4-(3-chlorobenzoyl)piperazine
CID 720140
Bibx-79
CID 501396
1-(3-Chlorobenzoyl)piperazine
CID 1074765
N-Benzyl-2-chloro-benzamide
CID 347073

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-cyclohexyl-N-ethylbenzamide?
The IUPAC name of 3-chloro-N-cyclohexyl-N-ethylbenzamide (CID 587324) is 3-chloro-N-cyclohexyl-N-ethylbenzamide.
What is the SMILES notation for 3-chloro-N-cyclohexyl-N-ethylbenzamide?
The canonical SMILES for 3-chloro-N-cyclohexyl-N-ethylbenzamide is CCN(C(=O)c1cccc(Cl)c1)C1CCCCC1.
What is the InChIKey of 3-chloro-N-cyclohexyl-N-ethylbenzamide?
The InChIKey is DVILLGOZMSCQDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO/c1-2-17(14-9-4-3-5-10-14)15(18)12-7-6-8-13(16)11-12/h6-8,11,14H,2-5,9-10H2,1H3.
What are the key properties of 3-chloro-N-cyclohexyl-N-ethylbenzamide?
3-chloro-N-cyclohexyl-N-ethylbenzamide has a molecular weight of 265.78 g/mol, XLogP of 4.13, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-cyclohexyl-N-ethylbenzamide is sourced from PubChem (CID 587324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).