2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride

C17H27ClN2O2 — CID 119686106

IUPAC2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride
SMILESCC(C)c1ccc(C(C)NC(=O)CC2CNCCO2)cc1.Cl
InChIInChI=1S/C17H26N2O2.ClH/c1-12(2)14-4-6-15(7-5-14)13(3)19-17(20)10-16-11-18-8-9-21-16;/h4-7,12-13,16,18H,8-11H2,1-3H3,(H,19,20);1H
InChIKeyHYUWDOKQQJGJCC-UHFFFAOYSA-N
MW326.87 g/mol
LogP2.79
Rot. Bonds5

About 2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride

2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride (PubChem CID 119686106) has the molecular formula C17H27ClN2O2 and a molecular weight of 326.87 g/mol. Its IUPAC name is 2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride
PubChem CID119686106
Molecular FormulaC17H27ClN2O2
Molecular Weight326.87 g/mol
Exact Mass326.18
IUPAC Name2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride
SMILESCC(C)c1ccc(C(C)NC(=O)CC2CNCCO2)cc1.Cl
InChIInChI=1S/C17H26N2O2.ClH/c1-12(2)14-4-6-15(7-5-14)13(3)19-17(20)10-16-11-18-8-9-21-16;/h4-7,12-13,16,18H,8-11H2,1-3H3,(H,19,20);1H
InChIKeyHYUWDOKQQJGJCC-UHFFFAOYSA-N
XLogP2.79
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.87
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride?
The IUPAC name of 2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride (CID 119686106) is 2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride.
What is the SMILES notation for 2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride?
The canonical SMILES for 2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride is CC(C)c1ccc(C(C)NC(=O)CC2CNCCO2)cc1.Cl.
What is the InChIKey of 2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride?
The InChIKey is HYUWDOKQQJGJCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2.ClH/c1-12(2)14-4-6-15(7-5-14)13(3)19-17(20)10-16-11-18-8-9-21-16;/h4-7,12-13,16,18H,8-11H2,1-3H3,(H,19,20);1H.
What are the key properties of 2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride?
2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride has a molecular weight of 326.87 g/mol, XLogP of 2.79, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride is sourced from PubChem (CID 119686106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).