2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide

C17H26N2O2 — CID 79871763

IUPAC2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CNC1CCCCC1(C)C
InChIInChI=1S/C17H26N2O2/c1-17(2)11-7-6-10-15(17)18-12-16(20)19-13-8-4-5-9-14(13)21-3/h4-5,8-9,15,18H,6-7,10-12H2,1-3H3,(H,19,20)
InChIKeyXFTCMMGAXJDFPU-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.19
Rot. Bonds5

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

2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide (PubChem CID 79871763) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide
PubChem CID79871763
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CNC1CCCCC1(C)C
InChIInChI=1S/C17H26N2O2/c1-17(2)11-7-6-10-15(17)18-12-16(20)19-13-8-4-5-9-14(13)21-3/h4-5,8-9,15,18H,6-7,10-12H2,1-3H3,(H,19,20)
InChIKeyXFTCMMGAXJDFPU-UHFFFAOYSA-N
XLogP3.19
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopentyloxyamino)-N-(2-methoxyphenyl)acetamide
CID 83228402
2-[(1-hydroxycyclopentyl)methylamino]-N-(2-methoxyphenyl)acetamide
CID 65109213
2-[(2,3-dimethylcyclopentyl)amino]-N-(2-methoxyphenyl)acetamide
CID 64909122
2-cyclohexyl-N-(2-methoxyphenyl)acetamide
CID 880879
N-[2-(2-methoxyanilino)-2-oxoethyl]cyclobutanecarboxamide
CID 112998571
N-[2-(2-methoxyanilino)-2-oxoethyl]cyclopropanecarboxamide
CID 110687182
2-(1-hydroxycyclohexyl)-N-(2-methoxyphenyl)acetamide
CID 111331493
2-(1-aminocyclohexyl)-N-(2-methoxyphenyl)acetamide
CID 64685514
2-[(3-ethyl-2-methylcyclopentyl)amino]-N-(2-methoxyphenyl)acetamide
CID 64920995
3-[[(1R)-3,3-dimethylcyclohexyl]amino]-N-(2-methoxyphenyl)propanamide
CID 95210776
2-[(4-hydroxycyclohexyl)methylamino]-N-(2-methoxyphenyl)acetamide
CID 106133704
[2-(2-methoxyanilino)-2-oxoethyl] cyclopentanecarboxylate
CID 2364845

Frequently Asked Questions

What is the IUPAC name of 2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide (CID 79871763) is 2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)CNC1CCCCC1(C)C.
What is the InChIKey of 2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide?
The InChIKey is XFTCMMGAXJDFPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-17(2)11-7-6-10-15(17)18-12-16(20)19-13-8-4-5-9-14(13)21-3/h4-5,8-9,15,18H,6-7,10-12H2,1-3H3,(H,19,20).
What are the key properties of 2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide?
2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide has a molecular weight of 290.41 g/mol, XLogP of 3.19, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2-dimethylcyclohexyl)amino]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 79871763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).