N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide

C16H23ClN2O — CID 63995689

IUPACN-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide
SMILESCC1CCC(NCC(=O)Nc2ccc(Cl)cc2)C(C)C1
InChIInChI=1S/C16H23ClN2O/c1-11-3-8-15(12(2)9-11)18-10-16(20)19-14-6-4-13(17)5-7-14/h4-7,11-12,15,18H,3,8-10H2,1-2H3,(H,19,20)
InChIKeyFELXDKKJAKQIEQ-UHFFFAOYSA-N
MW294.83 g/mol
LogP3.69
Rot. Bonds4

About N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide

N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide (PubChem CID 63995689) has the molecular formula C16H23ClN2O and a molecular weight of 294.83 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide
PubChem CID63995689
Molecular FormulaC16H23ClN2O
Molecular Weight294.83 g/mol
Exact Mass294.15
IUPAC NameN-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide
SMILESCC1CCC(NCC(=O)Nc2ccc(Cl)cc2)C(C)C1
InChIInChI=1S/C16H23ClN2O/c1-11-3-8-15(12(2)9-11)18-10-16(20)19-14-6-4-13(17)5-7-14/h4-7,11-12,15,18H,3,8-10H2,1-2H3,(H,19,20)
InChIKeyFELXDKKJAKQIEQ-UHFFFAOYSA-N
XLogP3.69
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.83
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chlorophenyl)-2-[(2,3-dimethylcyclohexyl)amino]acetamide
CID 43078612
N-(4-chlorophenyl)-2-[(1,3-dimethylpiperidin-4-yl)amino]acetamide
CID 115713823
N-(2-bromophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide
CID 63994904
N-(4-chlorophenyl)-2-(cyclohexylamino)acetamide
CID 788648
2-[(2-methylcyclohexyl)amino]-N-(4-methylphenyl)acetamide
CID 43179972
N-(4-chlorophenyl)-2-[(2,6-dimethylpiperidin-1-yl)amino]acetamide
CID 83021450
N-(4-chlorophenyl)-2-[[2-(hydroxymethyl)cyclopentyl]amino]acetamide
CID 106360931
2-[(4-methylcyclohexyl)amino]-N-(4-methylphenyl)acetamide
CID 28579743
N-(4-chlorophenyl)-2-[(1,1-dioxothian-4-yl)amino]acetamide
CID 43615220
trans-(1R,2R)-N-[2-(4-chloroanilino)-2-oxoethyl]-N,2-dimethylcyclopropane-1-carboxamide
CID 9417409
2-[[2-(4-chloroanilino)-2-oxoethyl]-methylamino]-N-[(1R,2R)-2-methylcyclohexyl]acetamide
CID 9167461
N-[2-[[(2,4-dimethylcyclohexyl)amino]methyl]phenyl]acetamide
CID 66418273

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide (CID 63995689) is N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide is CC1CCC(NCC(=O)Nc2ccc(Cl)cc2)C(C)C1.
What is the InChIKey of N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide?
The InChIKey is FELXDKKJAKQIEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23ClN2O/c1-11-3-8-15(12(2)9-11)18-10-16(20)19-14-6-4-13(17)5-7-14/h4-7,11-12,15,18H,3,8-10H2,1-2H3,(H,19,20).
What are the key properties of N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide?
N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide has a molecular weight of 294.83 g/mol, XLogP of 3.69, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide is sourced from PubChem (CID 63995689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).