(1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride

C5H12ClN — CID 122236485

IUPAC(1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride
SMILESCC1(C)C[C@@H]1N.Cl
InChIInChI=1S/C5H11N.ClH/c1-5(2)3-4(5)6;/h4H,3,6H2,1-2H3;1H/t4-;/m0./s1
InChIKeyLIVDXAAZXJCHPC-WCCKRBBISA-N
MW121.61 g/mol
LogP1.17
Rot. Bonds

About (1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride

(1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride (PubChem CID 122236485) has the molecular formula C5H12ClN and a molecular weight of 121.61 g/mol. Its IUPAC name is (1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride.

Molecular Properties

Compound Name(1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride
PubChem CID122236485
Molecular FormulaC5H12ClN
Molecular Weight121.61 g/mol
Exact Mass121.07
IUPAC Name(1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride
SMILESCC1(C)C[C@@H]1N.Cl
InChIInChI=1S/C5H11N.ClH/c1-5(2)3-4(5)6;/h4H,3,6H2,1-2H3;1H/t4-;/m0./s1
InChIKeyLIVDXAAZXJCHPC-WCCKRBBISA-N
XLogP1.17
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.61
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride?
The IUPAC name of (1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride (CID 122236485) is (1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride.
What is the SMILES notation for (1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride?
The canonical SMILES for (1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride is CC1(C)C[C@@H]1N.Cl.
What is the InChIKey of (1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride?
The InChIKey is LIVDXAAZXJCHPC-WCCKRBBISA-N. The full InChI is InChI=1S/C5H11N.ClH/c1-5(2)3-4(5)6;/h4H,3,6H2,1-2H3;1H/t4-;/m0./s1.
What are the key properties of (1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride?
(1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride has a molecular weight of 121.61 g/mol, XLogP of 1.17, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-2,2-dimethylcyclopropan-1-amine;hydrochloride is sourced from PubChem (CID 122236485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).