2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide

C13H26N2O2 — CID 64603111

IUPAC2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide
SMILESCOCCC(C)NC(=O)CC1CCC(N)CC1
InChIInChI=1S/C13H26N2O2/c1-10(7-8-17-2)15-13(16)9-11-3-5-12(14)6-4-11/h10-12H,3-9,14H2,1-2H3,(H,15,16)
InChIKeyGLZRZZLLOAFYQU-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.44
Rot. Bonds6

About 2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide

2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide (PubChem CID 64603111) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide
PubChem CID64603111
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide
SMILESCOCCC(C)NC(=O)CC1CCC(N)CC1
InChIInChI=1S/C13H26N2O2/c1-10(7-8-17-2)15-13(16)9-11-3-5-12(14)6-4-11/h10-12H,3-9,14H2,1-2H3,(H,15,16)
InChIKeyGLZRZZLLOAFYQU-UHFFFAOYSA-N
XLogP1.44
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(aminomethyl)cyclohexyl]-N-(4-methoxybutan-2-yl)acetamide
CID 64604127
2-(3-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide
CID 64603511
2-(cyclopropylmethylamino)-N-(4-methoxybutan-2-yl)acetamide
CID 64606071
2-(4-aminocyclohexyl)-N-heptan-2-ylacetamide
CID 62781706
2-(4-aminocyclohexyl)-N-propan-2-ylacetamide
CID 62777737
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(4-methoxybutan-2-yl)acetamide
CID 79615755
2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide
CID 104830066
3-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide;hydrochloride
CID 119765560
5-amino-N-(4-methoxybutan-2-yl)-2-methylcyclohexane-1-carboxamide
CID 64603308
2-methoxy-N-(4-methoxybutan-2-yl)acetamide
CID 62612246
2-(4-aminocyclohexyl)-N-(1-hydroxy-4-methylpentan-2-yl)acetamide
CID 62782742
3-(4-methoxybutan-2-ylamino)-3-oxopropanoic acid
CID 64604730

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide?
The IUPAC name of 2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide (CID 64603111) is 2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide.
What is the SMILES notation for 2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide?
The canonical SMILES for 2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide is COCCC(C)NC(=O)CC1CCC(N)CC1.
What is the InChIKey of 2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide?
The InChIKey is GLZRZZLLOAFYQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-10(7-8-17-2)15-13(16)9-11-3-5-12(14)6-4-11/h10-12H,3-9,14H2,1-2H3,(H,15,16).
What are the key properties of 2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide?
2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide has a molecular weight of 242.36 g/mol, XLogP of 1.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide is sourced from PubChem (CID 64603111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).