N-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide

C19H19Cl2NO — CID 53446248

IUPACN-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide
SMILESCc1cc(Cl)cc(Cl)c1N(C=O)C1(c2ccccc2)CCCC1
InChIInChI=1S/C19H19Cl2NO/c1-14-11-16(20)12-17(21)18(14)22(13-23)19(9-5-6-10-19)15-7-3-2-4-8-15/h2-4,7-8,11-13H,5-6,9-10H2,1H3
InChIKeyDLXBRGMZFSWNLA-UHFFFAOYSA-N
MW348.27 g/mol
LogP5.73
Rot. Bonds4

About N-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide

N-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide (PubChem CID 53446248) has the molecular formula C19H19Cl2NO and a molecular weight of 348.27 g/mol. Its IUPAC name is N-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide.

Molecular Properties

Compound NameN-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide
PubChem CID53446248
Molecular FormulaC19H19Cl2NO
Molecular Weight348.27 g/mol
Exact Mass347.08
IUPAC NameN-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide
SMILESCc1cc(Cl)cc(Cl)c1N(C=O)C1(c2ccccc2)CCCC1
InChIInChI=1S/C19H19Cl2NO/c1-14-11-16(20)12-17(21)18(14)22(13-23)19(9-5-6-10-19)15-7-3-2-4-8-15/h2-4,7-8,11-13H,5-6,9-10H2,1H3
InChIKeyDLXBRGMZFSWNLA-UHFFFAOYSA-N
XLogP5.73
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.27
LogP ≤ 55.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(2-chloro-4-fluorophenyl)-N-(1-phenylcyclopentyl)formamide
CID 53446272
N-(4-chloro-2-fluorophenyl)-N-(1-phenylcyclopentyl)formamide
CID 53446614
N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide
CID 57367348
N-benzyl-N-(2,4-dichlorophenyl)formamide
CID 14170852
N-benzyl-N-(2,4,6-trichlorophenyl)formamide
CID 87333520
N-benzyl-N-(2,6-dichlorophenyl)formamide
CID 87333755
N-(2-chlorophenyl)-N-[2-(4,4-dimethylhexan-2-yl)phenyl]formamide
CID 87734438
6,8-dichloro-3,4-dihydro-2H-quinoline-1-carbaldehyde
CID 87825432
Tert-butyl-(2-chloro-6-phenylphenyl)carbamic acid
CID 118274853
N-(2,4-dichlorophenyl)-N-(1-phenylcyclopentyl)formamide
CID 53446249
N-(2,6-dichloro-3-methylphenyl)-N-(1-phenylcyclopentyl)formamide
CID 53446259
N-(2-chloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide
CID 53446278

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide?
The IUPAC name of N-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide (CID 53446248) is N-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide.
What is the SMILES notation for N-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide?
The canonical SMILES for N-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide is Cc1cc(Cl)cc(Cl)c1N(C=O)C1(c2ccccc2)CCCC1.
What is the InChIKey of N-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide?
The InChIKey is DLXBRGMZFSWNLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19Cl2NO/c1-14-11-16(20)12-17(21)18(14)22(13-23)19(9-5-6-10-19)15-7-3-2-4-8-15/h2-4,7-8,11-13H,5-6,9-10H2,1H3.
What are the key properties of N-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide?
N-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide has a molecular weight of 348.27 g/mol, XLogP of 5.73, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichloro-6-methylphenyl)-N-(1-phenylcyclopentyl)formamide is sourced from PubChem (CID 53446248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).