(2R)-4,4-dimethylpentan-2-amine;hydrochloride

C7H18ClN — CID 164901043

IUPAC(2R)-4,4-dimethylpentan-2-amine;hydrochloride
SMILESC[C@@H](N)CC(C)(C)C.Cl
InChIInChI=1S/C7H17N.ClH/c1-6(8)5-7(2,3)4;/h6H,5,8H2,1-4H3;1H/t6-;/m1./s1
InChIKeyLJTPCFLSHIIRAL-FYZOBXCZSA-N
MW151.68 g/mol
LogP2.19
Rot. Bonds1

About (2R)-4,4-dimethylpentan-2-amine;hydrochloride

(2R)-4,4-dimethylpentan-2-amine;hydrochloride (PubChem CID 164901043) has the molecular formula C7H18ClN and a molecular weight of 151.68 g/mol. Its IUPAC name is (2R)-4,4-dimethylpentan-2-amine;hydrochloride.

Molecular Properties

Compound Name(2R)-4,4-dimethylpentan-2-amine;hydrochloride
PubChem CID164901043
Molecular FormulaC7H18ClN
Molecular Weight151.68 g/mol
Exact Mass151.11
IUPAC Name(2R)-4,4-dimethylpentan-2-amine;hydrochloride
SMILESC[C@@H](N)CC(C)(C)C.Cl
InChIInChI=1S/C7H17N.ClH/c1-6(8)5-7(2,3)4;/h6H,5,8H2,1-4H3;1H/t6-;/m1./s1
InChIKeyLJTPCFLSHIIRAL-FYZOBXCZSA-N
XLogP2.19
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.68
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(4S)-2-methylpentane-2,4-diamine
CID 55284810
3-amino-5,5-dimethylhexan-1-ol;hydrochloride
CID 55255759
2,2,6,6-tetramethylheptane-3,4-diamine
CID 175410275
2,2,5-trimethyloctan-4-amine
CID 107893664
ethane;2,2,4,6,6-pentamethylheptane
CID 142211592
3-fluoro-5,5-dimethylhexan-2-amine
CID 105429117
5-bromo-4,4-dimethylpentan-2-amine
CID 126606470
4-amino-2,2-dimethylpentane-1-thiol
CID 89113826
2,5,5,6,9,9-hexamethyldecane-3,7-diamine
CID 130251499
(3R)-3-amino-5,5-dimethylhexan-1-ol
CID 58554650
4,4,5-trimethylheptan-2-amine
CID 79446390
(4S)-2,4,6,6-tetramethylheptan-2-amine
CID 167006603

Frequently Asked Questions

What is the IUPAC name of (2R)-4,4-dimethylpentan-2-amine;hydrochloride?
The IUPAC name of (2R)-4,4-dimethylpentan-2-amine;hydrochloride (CID 164901043) is (2R)-4,4-dimethylpentan-2-amine;hydrochloride.
What is the SMILES notation for (2R)-4,4-dimethylpentan-2-amine;hydrochloride?
The canonical SMILES for (2R)-4,4-dimethylpentan-2-amine;hydrochloride is C[C@@H](N)CC(C)(C)C.Cl.
What is the InChIKey of (2R)-4,4-dimethylpentan-2-amine;hydrochloride?
The InChIKey is LJTPCFLSHIIRAL-FYZOBXCZSA-N. The full InChI is InChI=1S/C7H17N.ClH/c1-6(8)5-7(2,3)4;/h6H,5,8H2,1-4H3;1H/t6-;/m1./s1.
What are the key properties of (2R)-4,4-dimethylpentan-2-amine;hydrochloride?
(2R)-4,4-dimethylpentan-2-amine;hydrochloride has a molecular weight of 151.68 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4,4-dimethylpentan-2-amine;hydrochloride is sourced from PubChem (CID 164901043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).