N-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride

C13H27ClN2O2 — CID 3065801

IUPACN-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride
SMILESCC(C)CC(C)(C)NC(=O)CN1CCOCC1.Cl
InChIInChI=1S/C13H26N2O2.ClH/c1-11(2)9-13(3,4)14-12(16)10-15-5-7-17-8-6-15;/h11H,5-10H2,1-4H3,(H,14,16);1H
InChIKeyOWIQXXQCCRRQCA-UHFFFAOYSA-N
MW278.82 g/mol
LogP1.68
Rot. Bonds5

About N-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride

N-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride (PubChem CID 3065801) has the molecular formula C13H27ClN2O2 and a molecular weight of 278.82 g/mol. Its IUPAC name is N-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride
PubChem CID3065801
Molecular FormulaC13H27ClN2O2
Molecular Weight278.82 g/mol
Exact Mass278.18
IUPAC NameN-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride
SMILESCC(C)CC(C)(C)NC(=O)CN1CCOCC1.Cl
InChIInChI=1S/C13H26N2O2.ClH/c1-11(2)9-13(3,4)14-12(16)10-15-5-7-17-8-6-15;/h11H,5-10H2,1-4H3,(H,14,16);1H
InChIKeyOWIQXXQCCRRQCA-UHFFFAOYSA-N
XLogP1.68
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.82
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride?
The IUPAC name of N-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride (CID 3065801) is N-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride.
What is the SMILES notation for N-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride?
The canonical SMILES for N-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride is CC(C)CC(C)(C)NC(=O)CN1CCOCC1.Cl.
What is the InChIKey of N-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride?
The InChIKey is OWIQXXQCCRRQCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2.ClH/c1-11(2)9-13(3,4)14-12(16)10-15-5-7-17-8-6-15;/h11H,5-10H2,1-4H3,(H,14,16);1H.
What are the key properties of N-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride?
N-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride has a molecular weight of 278.82 g/mol, XLogP of 1.68, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylpentan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride is sourced from PubChem (CID 3065801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).