cyclopropylmethylazanium chloride

C4H10ClN — CID 11355452

IUPACcyclopropylmethylazanium chloride
SMILES[Cl-].[NH3+]CC1CC1
InChIInChI=1S/C4H9N.ClH/c5-3-4-1-2-4;/h4H,1-3,5H2;1H
InChIKeyHXSNGAHNYZBZTH-UHFFFAOYSA-N
MW107.58 g/mol
LogP-3.36
Rot. Bonds1

About cyclopropylmethylazanium chloride

cyclopropylmethylazanium chloride (PubChem CID 11355452) has the molecular formula C4H10ClN and a molecular weight of 107.58 g/mol. Its IUPAC name is cyclopropylmethylazanium chloride.

Molecular Properties

Compound Namecyclopropylmethylazanium chloride
PubChem CID11355452
Molecular FormulaC4H10ClN
Molecular Weight107.58 g/mol
Exact Mass107.05
IUPAC Namecyclopropylmethylazanium chloride
SMILES[Cl-].[NH3+]CC1CC1
InChIInChI=1S/C4H9N.ClH/c5-3-4-1-2-4;/h4H,1-3,5H2;1H
InChIKeyHXSNGAHNYZBZTH-UHFFFAOYSA-N
XLogP-3.36
TPSA27.64 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.58
LogP ≤ 5-3.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Analyze cyclopropylmethylazanium chloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Cyclopropanemethanamine
CID 75646
(Cyclopropylmethyl)ammonium chloride
CID 81671
2-Cyclopropylethanamine hydrochloride
CID 21916080
(2-Methylcyclopropyl)methanamine hydrochloride
CID 42944929
(2,2-Difluorocyclopropyl)methanamine hydrochloride
CID 75480932
(1R,2R)-2-methylcyclopropan-1-amine hydrochloride
CID 118798395
(1S,2S)-2-methylcyclopropan-1-amine hydrochloride
CID 135324357
rac-(1R,2S)-2-methylcyclopropan-1-amine hydrochloride
CID 146012745
rac-1-((1R,2R)-2-fluorocyclopropyl)methanamine hydrochloride
CID 155820456
rac-((1R,2R)-2-methylcyclopropyl)methanamine hydrochloride
CID 118992743
rac-(1R,2R)-2-(fluoromethyl)cyclopropan-1-amine hydrochloride
CID 136589399
rac-(1R,2S)-2-(fluoromethyl)cyclopropan-1-amine hydrochloride
CID 145874600

Frequently Asked Questions

What is the IUPAC name of cyclopropylmethylazanium chloride?
The IUPAC name of cyclopropylmethylazanium chloride (CID 11355452) is cyclopropylmethylazanium chloride.
What is the SMILES notation for cyclopropylmethylazanium chloride?
The canonical SMILES for cyclopropylmethylazanium chloride is [Cl-].[NH3+]CC1CC1.
What is the InChIKey of cyclopropylmethylazanium chloride?
The InChIKey is HXSNGAHNYZBZTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N.ClH/c5-3-4-1-2-4;/h4H,1-3,5H2;1H.
What are the key properties of cyclopropylmethylazanium chloride?
cyclopropylmethylazanium chloride has a molecular weight of 107.58 g/mol, XLogP of -3.36, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropylmethylazanium chloride is sourced from PubChem (CID 11355452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).