(2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide

C15H20ClNO — CID 97357253

IUPAC(2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide
SMILESC[C@@H](Cl)C(=O)N(c1ccccc1)C1CCCCC1
InChIInChI=1S/C15H20ClNO/c1-12(16)15(18)17(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2,4-5,8-9,12,14H,3,6-7,10-11H2,1H3/t12-/m1/s1
InChIKeyBHWXYSYRGQKPJH-GFCCVEGCSA-N
MW265.78 g/mol
LogP3.98
Rot. Bonds3

About (2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide

(2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide (PubChem CID 97357253) has the molecular formula C15H20ClNO and a molecular weight of 265.78 g/mol. Its IUPAC name is (2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide.

Molecular Properties

Compound Name(2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide
PubChem CID97357253
Molecular FormulaC15H20ClNO
Molecular Weight265.78 g/mol
Exact Mass265.12
IUPAC Name(2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide
SMILESC[C@@H](Cl)C(=O)N(c1ccccc1)C1CCCCC1
InChIInChI=1S/C15H20ClNO/c1-12(16)15(18)17(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2,4-5,8-9,12,14H,3,6-7,10-11H2,1H3/t12-/m1/s1
InChIKeyBHWXYSYRGQKPJH-GFCCVEGCSA-N
XLogP3.98
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 ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexyl-N-phenylcarbamoyl chloride
CID 18329458
2-chloro-N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
CID 139032969
2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide
CID 167887997
2-chloro-N-hydroxy-N-phenylpropanamide
CID 57100198
[2-(N-cyclohexylanilino)-2-oxoethyl]-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium
CID 9050143
1-[1-[[2-(N-cyclohexylanilino)-2-oxoethyl]amino]ethyl]cyclopentane-1-carboxylic acid
CID 90738858
(2R)-N-cyclohexyl-N-methyl-2-(N-methylsulfonylanilino)propanamide
CID 94018728
N-cyclohexyl-2-[2-[2-(N-cyclohexylanilino)-2-oxoethoxy]phenoxy]-N-phenylacetamide
CID 102017753
cyclohexyl-(2-methylphenyl)carbamic acid
CID 151470608
[2-(N-cyclohexylanilino)-2-oxoethyl]-[2-(methylamino)-2-oxoethyl]azanium
CID 8772439
N-cyclohexyl-N-phenyl-2-piperidin-4-ylacetamide
CID 174812391
chloro N-cyclopropyl-N-phenylcarbamate
CID 174185498

Frequently Asked Questions

What is the IUPAC name of (2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide?
The IUPAC name of (2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide (CID 97357253) is (2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide.
What is the SMILES notation for (2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide?
The canonical SMILES for (2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide is C[C@@H](Cl)C(=O)N(c1ccccc1)C1CCCCC1.
What is the InChIKey of (2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide?
The InChIKey is BHWXYSYRGQKPJH-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H20ClNO/c1-12(16)15(18)17(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2,4-5,8-9,12,14H,3,6-7,10-11H2,1H3/t12-/m1/s1.
What are the key properties of (2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide?
(2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide has a molecular weight of 265.78 g/mol, XLogP of 3.98, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide is sourced from PubChem (CID 97357253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).