N,2-dimethylprop-2-en-1-amine;hydrochloride

C5H12ClN — CID 134690937

IUPACN,2-dimethylprop-2-en-1-amine;hydrochloride
SMILESC=C(C)CNC.Cl
InChIInChI=1S/C5H11N.ClH/c1-5(2)4-6-3;/h6H,1,4H2,2-3H3;1H
InChIKeyGCNVREMXOWMOQW-UHFFFAOYSA-N
MW121.61 g/mol
LogP1.20
Rot. Bonds2

About N,2-dimethylprop-2-en-1-amine;hydrochloride

N,2-dimethylprop-2-en-1-amine;hydrochloride (PubChem CID 134690937) has the molecular formula C5H12ClN and a molecular weight of 121.61 g/mol. Its IUPAC name is N,2-dimethylprop-2-en-1-amine;hydrochloride.

Molecular Properties

Compound NameN,2-dimethylprop-2-en-1-amine;hydrochloride
PubChem CID134690937
Molecular FormulaC5H12ClN
Molecular Weight121.61 g/mol
Exact Mass121.07
IUPAC NameN,2-dimethylprop-2-en-1-amine;hydrochloride
SMILESC=C(C)CNC.Cl
InChIInChI=1S/C5H11N.ClH/c1-5(2)4-6-3;/h6H,1,4H2,2-3H3;1H
InChIKeyGCNVREMXOWMOQW-UHFFFAOYSA-N
XLogP1.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.61
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-Propen-1-amine, N-ethyl-2-methyl-
CID 87587
Bis(2-methylprop-2-en-1-yl)amine
CID 233709
2-Methylallylamine hydrochloride
CID 11953772
Methyl methallylamine
CID 3478594
3-methyl-2,5-dihydro-1H-pyrrole hydrochloride
CID 13619722
N,N'-dimethyl-2-methylene-trimethylenediamine
CID 12427674
1-fluoro-N,2-dimethylprop-2-en-1-amine
CID 139550995
Bis(2-methylallyl)amine hydrochloride
CID 21496889
CID 139244195
CID 139244195
(E)-N,2-dimethylbut-2-en-1-amine
CID 13149681
N,2-dimethylbuta-2,3-dien-1-amine
CID 13601831
2-methyl-N-propylprop-2-en-1-amine
CID 19418239

Frequently Asked Questions

What is the IUPAC name of N,2-dimethylprop-2-en-1-amine;hydrochloride?
The IUPAC name of N,2-dimethylprop-2-en-1-amine;hydrochloride (CID 134690937) is N,2-dimethylprop-2-en-1-amine;hydrochloride.
What is the SMILES notation for N,2-dimethylprop-2-en-1-amine;hydrochloride?
The canonical SMILES for N,2-dimethylprop-2-en-1-amine;hydrochloride is C=C(C)CNC.Cl.
What is the InChIKey of N,2-dimethylprop-2-en-1-amine;hydrochloride?
The InChIKey is GCNVREMXOWMOQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N.ClH/c1-5(2)4-6-3;/h6H,1,4H2,2-3H3;1H.
What are the key properties of N,2-dimethylprop-2-en-1-amine;hydrochloride?
N,2-dimethylprop-2-en-1-amine;hydrochloride has a molecular weight of 121.61 g/mol, XLogP of 1.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethylprop-2-en-1-amine;hydrochloride is sourced from PubChem (CID 134690937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).