2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide

C15H29NO2 — CID 115270396

IUPAC2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide
SMILESCCC(CC)C(=O)N(C)C1CCC(CCO)CC1
InChIInChI=1S/C15H29NO2/c1-4-13(5-2)15(18)16(3)14-8-6-12(7-9-14)10-11-17/h12-14,17H,4-11H2,1-3H3
InChIKeyQEOZKHPWTFBRKN-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.82
Rot. Bonds6

About 2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide

2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide (PubChem CID 115270396) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is 2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide.

Molecular Properties

Compound Name2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide
PubChem CID115270396
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide
SMILESCCC(CC)C(=O)N(C)C1CCC(CCO)CC1
InChIInChI=1S/C15H29NO2/c1-4-13(5-2)15(18)16(3)14-8-6-12(7-9-14)10-11-17/h12-14,17H,4-11H2,1-3H3
InChIKeyQEOZKHPWTFBRKN-UHFFFAOYSA-N
XLogP2.82
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclobutyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylacetamide
CID 116817264
3-cyclobutyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropanamide
CID 116817268
N-cyclobutyl-4-(2-hydroxyethyl)-N-methylcyclohexane-1-carboxamide
CID 115151010
2-[[[(4-ethylcyclohexyl)-methylcarbamoyl]amino]methyl]butanoic acid
CID 65223298
3-[(4-ethylcyclohexyl)-methylamino]-2-methyl-3-oxopropanoic acid
CID 114897738
N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide
CID 116817251
2-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)butanamide
CID 62547118
2-chloro-N-cyclohexyl-N-methylbutanamide
CID 121204557
N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylfuran-2-carboxamide
CID 115270397
(2S)-2-amino-N-cyclobutyl-2-[4-(hydroxymethyl)cyclohexyl]-N-methylacetamide
CID 70337489
[4-(2-hydroxyethyl)cyclohexyl]methyl-methylcarbamic acid
CID 22310808
(2S)-2-amino-N-cyclobutyl-3-hydroxy-N-methylpropanamide
CID 70338344

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide?
The IUPAC name of 2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide (CID 115270396) is 2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide.
What is the SMILES notation for 2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide?
The canonical SMILES for 2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide is CCC(CC)C(=O)N(C)C1CCC(CCO)CC1.
What is the InChIKey of 2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide?
The InChIKey is QEOZKHPWTFBRKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-4-13(5-2)15(18)16(3)14-8-6-12(7-9-14)10-11-17/h12-14,17H,4-11H2,1-3H3.
What are the key properties of 2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide?
2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide has a molecular weight of 255.40 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide is sourced from PubChem (CID 115270396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).