2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide

C15H28N2O2 — CID 102676811

IUPAC2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide
SMILESCN(C(=O)CN(CCO)C1CCC1)C1CCCCC1
InChIInChI=1S/C15H28N2O2/c1-16(13-6-3-2-4-7-13)15(19)12-17(10-11-18)14-8-5-9-14/h13-14,18H,2-12H2,1H3
InChIKeyDMLUZSSANSGBPL-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.62
Rot. Bonds6

About 2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide

2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide (PubChem CID 102676811) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide.

Molecular Properties

Compound Name2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide
PubChem CID102676811
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide
SMILESCN(C(=O)CN(CCO)C1CCC1)C1CCCCC1
InChIInChI=1S/C15H28N2O2/c1-16(13-6-3-2-4-7-13)15(19)12-17(10-11-18)14-8-5-9-14/h13-14,18H,2-12H2,1H3
InChIKeyDMLUZSSANSGBPL-UHFFFAOYSA-N
XLogP1.62
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide?
The IUPAC name of 2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide (CID 102676811) is 2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide.
What is the SMILES notation for 2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide?
The canonical SMILES for 2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide is CN(C(=O)CN(CCO)C1CCC1)C1CCCCC1.
What is the InChIKey of 2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide?
The InChIKey is DMLUZSSANSGBPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-16(13-6-3-2-4-7-13)15(19)12-17(10-11-18)14-8-5-9-14/h13-14,18H,2-12H2,1H3.
What are the key properties of 2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide?
2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide has a molecular weight of 268.40 g/mol, XLogP of 1.62, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide is sourced from PubChem (CID 102676811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).