(2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride

C7H17ClN2O — CID 89440606

IUPAC(2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride
SMILESCC(C)[C@H](C(N)=O)N(C)C.Cl
InChIInChI=1S/C7H16N2O.ClH/c1-5(2)6(7(8)10)9(3)4;/h5-6H,1-4H3,(H2,8,10);1H/t6-;/m1./s1
InChIKeyYTKVJIQHGOKJIM-FYZOBXCZSA-N
MW180.68 g/mol
LogP0.48
Rot. Bonds3

About (2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride

(2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride (PubChem CID 89440606) has the molecular formula C7H17ClN2O and a molecular weight of 180.68 g/mol. Its IUPAC name is (2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride.

Molecular Properties

Compound Name(2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride
PubChem CID89440606
Molecular FormulaC7H17ClN2O
Molecular Weight180.68 g/mol
Exact Mass180.10
IUPAC Name(2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride
SMILESCC(C)[C@H](C(N)=O)N(C)C.Cl
InChIInChI=1S/C7H16N2O.ClH/c1-5(2)6(7(8)10)9(3)4;/h5-6H,1-4H3,(H2,8,10);1H/t6-;/m1./s1
InChIKeyYTKVJIQHGOKJIM-FYZOBXCZSA-N
XLogP0.48
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.68
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(dimethylamino)-3-methylbutanamide;prop-2-enal
CID 169183599
2-(dimethylamino)-3-methylbutanoic acid;hydrochloride
CID 71299250
(2S,3R)-2-(dimethylamino)-3-methoxybutanamide
CID 89440516
3-N,3-N,4-trimethylpent-1-ene-2,3-diamine
CID 156737008
2-[butyl(methyl)amino]-3-methylbutanamide
CID 82040476
N,N-dimethylmethanamine;2,3-di(propan-2-yl)butanediamide
CID 174612648
2-(dimethylamino)-3-methyl-N-sulfanylbutanamide
CID 166115605
N-(2-amino-2-methylpropyl)-2-(dimethylamino)-3-methylbutanamide;dihydrochloride
CID 119627492
2-aminopropanamide;dihydrochloride
CID 19963402
(2S)-2-(dimethylamino)-3,3-dimethylbutanamide
CID 87149989
1-[4-(aminomethyl)piperidin-1-yl]-2-(dimethylamino)-3-methylbutan-1-one;dihydrochloride
CID 119423303
cyclopentane;2-methylpropanamide
CID 142523492

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride?
The IUPAC name of (2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride (CID 89440606) is (2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride.
What is the SMILES notation for (2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride?
The canonical SMILES for (2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride is CC(C)[C@H](C(N)=O)N(C)C.Cl.
What is the InChIKey of (2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride?
The InChIKey is YTKVJIQHGOKJIM-FYZOBXCZSA-N. The full InChI is InChI=1S/C7H16N2O.ClH/c1-5(2)6(7(8)10)9(3)4;/h5-6H,1-4H3,(H2,8,10);1H/t6-;/m1./s1.
What are the key properties of (2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride?
(2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride has a molecular weight of 180.68 g/mol, XLogP of 0.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride is sourced from PubChem (CID 89440606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).