2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide

C15H20Cl2N2O — CID 64683924

IUPAC2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide
SMILESCc1ccc(Cl)c(NC(=O)CC2(N)CCCCC2)c1Cl
InChIInChI=1S/C15H20Cl2N2O/c1-10-5-6-11(16)14(13(10)17)19-12(20)9-15(18)7-3-2-4-8-15/h5-6H,2-4,7-9,18H2,1H3,(H,19,20)
InChIKeyRHTNKNGLIWVEEB-UHFFFAOYSA-N
MW315.24 g/mol
LogP4.29
Rot. Bonds3

About 2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide

2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide (PubChem CID 64683924) has the molecular formula C15H20Cl2N2O and a molecular weight of 315.24 g/mol. Its IUPAC name is 2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide
PubChem CID64683924
Molecular FormulaC15H20Cl2N2O
Molecular Weight315.24 g/mol
Exact Mass314.10
IUPAC Name2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide
SMILESCc1ccc(Cl)c(NC(=O)CC2(N)CCCCC2)c1Cl
InChIInChI=1S/C15H20Cl2N2O/c1-10-5-6-11(16)14(13(10)17)19-12(20)9-15(18)7-3-2-4-8-15/h5-6H,2-4,7-9,18H2,1H3,(H,19,20)
InChIKeyRHTNKNGLIWVEEB-UHFFFAOYSA-N
XLogP4.29
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.24
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide?
The IUPAC name of 2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide (CID 64683924) is 2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide.
What is the SMILES notation for 2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide?
The canonical SMILES for 2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide is Cc1ccc(Cl)c(NC(=O)CC2(N)CCCCC2)c1Cl.
What is the InChIKey of 2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide?
The InChIKey is RHTNKNGLIWVEEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O/c1-10-5-6-11(16)14(13(10)17)19-12(20)9-15(18)7-3-2-4-8-15/h5-6H,2-4,7-9,18H2,1H3,(H,19,20).
What are the key properties of 2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide?
2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide has a molecular weight of 315.24 g/mol, XLogP of 4.29, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclohexyl)-N-(2,6-dichloro-3-methylphenyl)acetamide is sourced from PubChem (CID 64683924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).