2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide

C15H20Cl2N2O — CID 47123114

IUPAC2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide
SMILESCC1CCC(NC(=O)CNc2cccc(Cl)c2Cl)CC1
InChIInChI=1S/C15H20Cl2N2O/c1-10-5-7-11(8-6-10)19-14(20)9-18-13-4-2-3-12(16)15(13)17/h2-4,10-11,18H,5-9H2,1H3,(H,19,20)
InChIKeyVZEISEAJLSPQQH-UHFFFAOYSA-N
MW315.24 g/mol
LogP4.10
Rot. Bonds4

About 2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide

2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide (PubChem CID 47123114) has the molecular formula C15H20Cl2N2O and a molecular weight of 315.24 g/mol. Its IUPAC name is 2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide
PubChem CID47123114
Molecular FormulaC15H20Cl2N2O
Molecular Weight315.24 g/mol
Exact Mass314.10
IUPAC Name2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide
SMILESCC1CCC(NC(=O)CNc2cccc(Cl)c2Cl)CC1
InChIInChI=1S/C15H20Cl2N2O/c1-10-5-7-11(8-6-10)19-14(20)9-18-13-4-2-3-12(16)15(13)17/h2-4,10-11,18H,5-9H2,1H3,(H,19,20)
InChIKeyVZEISEAJLSPQQH-UHFFFAOYSA-N
XLogP4.10
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.24
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-acetylpiperidin-4-yl)-2-(2,3-dichloroanilino)acetamide
CID 86910665
N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide
CID 47133418
N-[3-[[2-(2,3-dichloroanilino)acetyl]amino]-2-methylphenyl]cyclopropanecarboxamide
CID 54815961
2-(2-chlorophenyl)sulfanyl-N-(4-methylcyclohexyl)acetamide
CID 7950418
N-(1-acetylpiperidin-4-yl)-2-(3-chloro-2-methylanilino)acetamide
CID 86910543
N-[4-chloro-3-[[2-[(4-methylcyclohexyl)amino]-2-oxoethyl]amino]phenyl]butanamide
CID 112800272
N-cyclopropyl-2-(naphthalen-1-ylamino)acetamide
CID 26506369
N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide
CID 33162844
N-(4-acetamidophenyl)-2-(2,3-dichloroanilino)acetamide
CID 54816111
2-(2-bromo-4-methylanilino)-N-(4-methylcyclohexyl)acetamide
CID 37273913
2-(2,3-dichloroanilino)-N-heptylacetamide
CID 54816059
N-cyclopropyl-2-(2,6-dichlorophenyl)acetamide
CID 2682749

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide?
The IUPAC name of 2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide (CID 47123114) is 2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide?
The canonical SMILES for 2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide is CC1CCC(NC(=O)CNc2cccc(Cl)c2Cl)CC1.
What is the InChIKey of 2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide?
The InChIKey is VZEISEAJLSPQQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O/c1-10-5-7-11(8-6-10)19-14(20)9-18-13-4-2-3-12(16)15(13)17/h2-4,10-11,18H,5-9H2,1H3,(H,19,20).
What are the key properties of 2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide?
2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide has a molecular weight of 315.24 g/mol, XLogP of 4.10, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide is sourced from PubChem (CID 47123114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).