N-cycloheptyl-2-(2,4-dichlorophenyl)acetamide

C15H19Cl2NO — CID 2712577

IUPACN-cycloheptyl-2-(2,4-dichlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1Cl)NC1CCCCCC1
InChIInChI=1S/C15H19Cl2NO/c16-12-8-7-11(14(17)10-12)9-15(19)18-13-5-3-1-2-4-6-13/h7-8,10,13H,1-6,9H2,(H,18,19)
InChIKeyBLWIPGHFZSFBJT-UHFFFAOYSA-N
MW300.23 g/mol
LogP4.37
Rot. Bonds3

About N-cycloheptyl-2-(2,4-dichlorophenyl)acetamide

N-cycloheptyl-2-(2,4-dichlorophenyl)acetamide (PubChem CID 2712577) has the molecular formula C15H19Cl2NO and a molecular weight of 300.23 g/mol. Its IUPAC name is N-cycloheptyl-2-(2,4-dichlorophenyl)acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-(2,4-dichlorophenyl)acetamide
PubChem CID2712577
Molecular FormulaC15H19Cl2NO
Molecular Weight300.23 g/mol
Exact Mass299.08
IUPAC NameN-cycloheptyl-2-(2,4-dichlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1Cl)NC1CCCCCC1
InChIInChI=1S/C15H19Cl2NO/c16-12-8-7-11(14(17)10-12)9-15(19)18-13-5-3-1-2-4-6-13/h7-8,10,13H,1-6,9H2,(H,18,19)
InChIKeyBLWIPGHFZSFBJT-UHFFFAOYSA-N
XLogP4.37
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.23
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-chloro-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-1,3-dimethylcyclobutane-1-carboxamide
CID 23550315
2,4-dichloro-N-propylbenzamide
CID 221797
2-(4-chlorophenyl)-N-cycloheptylacetamide
CID 875700
(2S)-2-(carbamoylamino)-N-[2-(2,4-dichlorophenyl)ethyl]-3-methylbutanamide
CID 2122018
2-(4-chlorophenyl)-N-(2-methylbutan-2-yl)acetamide
CID 977625
2,6-dichloro-N-(prop-2-en-1-yl)benzamide
CID 1769592
2-(3-Chloro-phenyl)-N-cyclohexyl-acetamide
CID 11379742
2,4-dichloro-N-(propan-2-yl)benzamide
CID 346755
4-(4-Chlorophenyl)azetidin-2-one
CID 23247926
U-48800
CID 137700072
N-(1-Benzyl-piperidin-4-yl)-2-(2,4-dichloro-phenyl)-acetamide
CID 4827344
2-(2,6-dichlorophenyl)-N-[2-(dimethylamino)-2-phenylethyl]acetamide
CID 4876873

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-(2,4-dichlorophenyl)acetamide?
The IUPAC name of N-cycloheptyl-2-(2,4-dichlorophenyl)acetamide (CID 2712577) is N-cycloheptyl-2-(2,4-dichlorophenyl)acetamide.
What is the SMILES notation for N-cycloheptyl-2-(2,4-dichlorophenyl)acetamide?
The canonical SMILES for N-cycloheptyl-2-(2,4-dichlorophenyl)acetamide is O=C(Cc1ccc(Cl)cc1Cl)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-2-(2,4-dichlorophenyl)acetamide?
The InChIKey is BLWIPGHFZSFBJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19Cl2NO/c16-12-8-7-11(14(17)10-12)9-15(19)18-13-5-3-1-2-4-6-13/h7-8,10,13H,1-6,9H2,(H,18,19).
What are the key properties of N-cycloheptyl-2-(2,4-dichlorophenyl)acetamide?
N-cycloheptyl-2-(2,4-dichlorophenyl)acetamide has a molecular weight of 300.23 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-(2,4-dichlorophenyl)acetamide is sourced from PubChem (CID 2712577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).