2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride

C14H31ClN2O — CID 3024809

IUPAC2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride
SMILESCCN(CC)CC(=O)NC(C)(C)CC(C)(C)C.Cl
InChIInChI=1S/C14H30N2O.ClH/c1-8-16(9-2)10-12(17)15-14(6,7)11-13(3,4)5;/h8-11H2,1-7H3,(H,15,17);1H
InChIKeyDJLSLBDQUJLWHN-UHFFFAOYSA-N
MW278.87 g/mol
LogP3.08
Rot. Bonds6

About 2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride

2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride (PubChem CID 3024809) has the molecular formula C14H31ClN2O and a molecular weight of 278.87 g/mol. Its IUPAC name is 2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride
PubChem CID3024809
Molecular FormulaC14H31ClN2O
Molecular Weight278.87 g/mol
Exact Mass278.21
IUPAC Name2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride
SMILESCCN(CC)CC(=O)NC(C)(C)CC(C)(C)C.Cl
InChIInChI=1S/C14H30N2O.ClH/c1-8-16(9-2)10-12(17)15-14(6,7)11-13(3,4)5;/h8-11H2,1-7H3,(H,15,17);1H
InChIKeyDJLSLBDQUJLWHN-UHFFFAOYSA-N
XLogP3.08
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.87
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Piperidineacetamide, N-(1,1-dimethylpentyl)-, hydrochloride
CID 3065937
Acetamide, 2-(diethylamino)-N-(1-ethyl-1-methylpropyl)-, hydrochloride
CID 60235
Acetamide, 2-(diethylamino)-N-tert-pentyl-, hydrochloride
CID 60313
Acetamide, 2-(dimethylamino)-N-(1,1,3,3-tetramethylbutyl)-, hydrochloride
CID 3024587
Propionamide, 3-(dimethylamino)-N-(1,1,3,3-tetramethylbutyl)-, hydrochloride
CID 3024638
1-Piperidineacetamide, N-(1,1,3-trimethylbutyl)-, hydrochloride
CID 3065919
Butyramide, 2-(diethylamino)-N-(1,1,3,3-tetramethylbutyl)-, hydrochloride
CID 3066084
1-Piperidineacetamide, N-(1,1,4-trimethylpentyl)-, hydrochloride
CID 3066159
1-Piperidineacetamide, 2-methyl-N-(1,1,3,3-tetramethylbutyl)-, hydrochloride
CID 3066179
Valeramide, 2-(diethylamino)-N-(1,1,3,3-tetramethylbutyl)-, hydrochloride
CID 3066331
1-Piperidineacetamide, N-(1,1,3,3-tetramethylbutyl)-, hydrochloride
CID 24842493
1-Pyrrolidineacetamide, N-(1,1,3,3-tetramethylbutyl)-, hydrochloride
CID 24845344

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride?
The IUPAC name of 2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride (CID 3024809) is 2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride is CCN(CC)CC(=O)NC(C)(C)CC(C)(C)C.Cl.
What is the InChIKey of 2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride?
The InChIKey is DJLSLBDQUJLWHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O.ClH/c1-8-16(9-2)10-12(17)15-14(6,7)11-13(3,4)5;/h8-11H2,1-7H3,(H,15,17);1H.
What are the key properties of 2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride?
2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride has a molecular weight of 278.87 g/mol, XLogP of 3.08, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride is sourced from PubChem (CID 3024809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).