2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride

C17H33ClN2O2 — CID 120793833

IUPAC2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride
SMILESCC(CCC1CCCCC1)NC(=O)C(N)C1CCOCC1.Cl
InChIInChI=1S/C17H32N2O2.ClH/c1-13(7-8-14-5-3-2-4-6-14)19-17(20)16(18)15-9-11-21-12-10-15;/h13-16H,2-12,18H2,1H3,(H,19,20);1H
InChIKeyNUQZZSUEDZUREB-UHFFFAOYSA-N
MW332.92 g/mol
LogP3.03
Rot. Bonds6

About 2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride

2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride (PubChem CID 120793833) has the molecular formula C17H33ClN2O2 and a molecular weight of 332.92 g/mol. Its IUPAC name is 2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride
PubChem CID120793833
Molecular FormulaC17H33ClN2O2
Molecular Weight332.92 g/mol
Exact Mass332.22
IUPAC Name2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride
SMILESCC(CCC1CCCCC1)NC(=O)C(N)C1CCOCC1.Cl
InChIInChI=1S/C17H32N2O2.ClH/c1-13(7-8-14-5-3-2-4-6-14)19-17(20)16(18)15-9-11-21-12-10-15;/h13-16H,2-12,18H2,1H3,(H,19,20);1H
InChIKeyNUQZZSUEDZUREB-UHFFFAOYSA-N
XLogP3.03
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.92
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2-cyclohexylethyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120787635
2-amino-N-(1-cyclopentylethyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120792981
(2S)-2-amino-N-(4-cyclohexylbutan-2-yl)-3-methylbutanamide
CID 119327911
2-amino-2-(oxan-4-yl)-N-[1-(oxolan-2-yl)propan-2-yl]acetamide;hydrochloride
CID 120791201
2-amino-2-(oxan-4-yl)-N-(4-phenylbutan-2-yl)acetamide;hydrochloride
CID 120782923
2-amino-N-(3-methylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120783425
2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride
CID 120783011
2-amino-N-[2-[(2-cyclohexylacetyl)amino]ethyl]-2-(oxan-4-yl)acetamide
CID 120791442
2-amino-N-[2-(3-methylcyclohexyl)ethyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120793045
2-amino-N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-2-(oxan-4-yl)acetamide
CID 120799022
N-(4-cyclohexylbutan-2-yl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119791225
2-amino-2-(oxan-4-yl)-N-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]acetamide;hydrochloride
CID 120792735

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride?
The IUPAC name of 2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride (CID 120793833) is 2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride is CC(CCC1CCCCC1)NC(=O)C(N)C1CCOCC1.Cl.
What is the InChIKey of 2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride?
The InChIKey is NUQZZSUEDZUREB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O2.ClH/c1-13(7-8-14-5-3-2-4-6-14)19-17(20)16(18)15-9-11-21-12-10-15;/h13-16H,2-12,18H2,1H3,(H,19,20);1H.
What are the key properties of 2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride?
2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride has a molecular weight of 332.92 g/mol, XLogP of 3.03, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride is sourced from PubChem (CID 120793833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).