(2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride

C6H13ClN2 — CID 18436311

IUPAC(2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride
SMILESCC(C)[C@@](C)(N)C#N.Cl
InChIInChI=1S/C6H12N2.ClH/c1-5(2)6(3,8)4-7;/h5H,8H2,1-3H3;1H/t6-;/m0./s1
InChIKeyMQVKUNJVBHHDSJ-RGMNGODLSA-N
MW148.64 g/mol
LogP1.31
Rot. Bonds1

About (2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride

(2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride (PubChem CID 18436311) has the molecular formula C6H13ClN2 and a molecular weight of 148.64 g/mol. Its IUPAC name is (2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride
PubChem CID18436311
Molecular FormulaC6H13ClN2
Molecular Weight148.64 g/mol
Exact Mass148.08
IUPAC Name(2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride
SMILESCC(C)[C@@](C)(N)C#N.Cl
InChIInChI=1S/C6H12N2.ClH/c1-5(2)6(3,8)4-7;/h5H,8H2,1-3H3;1H/t6-;/m0./s1
InChIKeyMQVKUNJVBHHDSJ-RGMNGODLSA-N
XLogP1.31
TPSA49.81 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.64
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-2,3-dimethylbutanenitrile
CID 735791
2-amino-3-methyl-2-propan-2-ylbutanenitrile
CID 71439279
3,4-dimethylpent-1-yn-3-amine
CID 10129922
(2S)-2-amino-2-chloropropanenitrile;hydrochloride
CID 88739568
(2R)-2-hydroxy-2,3-dimethylbutanenitrile
CID 12650901
2,3-dimethyl-2-silylbutanenitrile
CID 175377699
2,2-dimethylpropanenitrile;methane;2-methylpropanal
CID 159993493
2-(dimethylamino)-2,3-dimethylbutanenitrile
CID 43802640
2,3,4-trimethylpentan-3-amine;hydrobromide
CID 18185119
(2S)-2-aminopropanenitrile;hydrochloride
CID 71757440
2-amino-3-methoxy-2-methylpropanenitrile;hydrochloride
CID 88790067
bis(2-methylpropan-2-amine);dihydrochloride
CID 175186319

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride?
The IUPAC name of (2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride (CID 18436311) is (2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride.
What is the SMILES notation for (2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride?
The canonical SMILES for (2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride is CC(C)[C@@](C)(N)C#N.Cl.
What is the InChIKey of (2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride?
The InChIKey is MQVKUNJVBHHDSJ-RGMNGODLSA-N. The full InChI is InChI=1S/C6H12N2.ClH/c1-5(2)6(3,8)4-7;/h5H,8H2,1-3H3;1H/t6-;/m0./s1.
What are the key properties of (2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride?
(2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride has a molecular weight of 148.64 g/mol, XLogP of 1.31, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2,3-dimethylbutanenitrile;hydrochloride is sourced from PubChem (CID 18436311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).