2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride

C15H31ClN2O2 — CID 3066192

IUPAC2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride
SMILESCC(C(=O)NC(C)(C)CC(C)(C)C)N1CCOCC1.Cl
InChIInChI=1S/C15H30N2O2.ClH/c1-12(17-7-9-19-10-8-17)13(18)16-15(5,6)11-14(2,3)4;/h12H,7-11H2,1-6H3,(H,16,18);1H
InChIKeySSVCLLXQGUOGJR-UHFFFAOYSA-N
MW306.88 g/mol
LogP2.46
Rot. Bonds4

About 2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride

2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride (PubChem CID 3066192) has the molecular formula C15H31ClN2O2 and a molecular weight of 306.88 g/mol. Its IUPAC name is 2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride.

Molecular Properties

Compound Name2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride
PubChem CID3066192
Molecular FormulaC15H31ClN2O2
Molecular Weight306.88 g/mol
Exact Mass306.21
IUPAC Name2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride
SMILESCC(C(=O)NC(C)(C)CC(C)(C)C)N1CCOCC1.Cl
InChIInChI=1S/C15H30N2O2.ClH/c1-12(17-7-9-19-10-8-17)13(18)16-15(5,6)11-14(2,3)4;/h12H,7-11H2,1-6H3,(H,16,18);1H
InChIKeySSVCLLXQGUOGJR-UHFFFAOYSA-N
XLogP2.46
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.88
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride?
The IUPAC name of 2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride (CID 3066192) is 2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride.
What is the SMILES notation for 2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride?
The canonical SMILES for 2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride is CC(C(=O)NC(C)(C)CC(C)(C)C)N1CCOCC1.Cl.
What is the InChIKey of 2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride?
The InChIKey is SSVCLLXQGUOGJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2.ClH/c1-12(17-7-9-19-10-8-17)13(18)16-15(5,6)11-14(2,3)4;/h12H,7-11H2,1-6H3,(H,16,18);1H.
What are the key properties of 2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride?
2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride has a molecular weight of 306.88 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)propanamide;hydrochloride is sourced from PubChem (CID 3066192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).