cyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride

C7H11ClN2S — CID 162343507

IUPACcyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride
SMILESCl.NC(c1nccs1)C1CC1
InChIInChI=1S/C7H10N2S.ClH/c8-6(5-1-2-5)7-9-3-4-10-7;/h3-6H,1-2,8H2;1H
InChIKeyYAIGFVSNDXHJDG-UHFFFAOYSA-N
MW190.70 g/mol
LogP1.97
Rot. Bonds2

About cyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride

cyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride (PubChem CID 162343507) has the molecular formula C7H11ClN2S and a molecular weight of 190.70 g/mol. Its IUPAC name is cyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride.

Molecular Properties

Compound Namecyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride
PubChem CID162343507
Molecular FormulaC7H11ClN2S
Molecular Weight190.70 g/mol
Exact Mass190.03
IUPAC Namecyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride
SMILESCl.NC(c1nccs1)C1CC1
InChIInChI=1S/C7H10N2S.ClH/c8-6(5-1-2-5)7-9-3-4-10-7;/h3-6H,1-2,8H2;1H
InChIKeyYAIGFVSNDXHJDG-UHFFFAOYSA-N
XLogP1.97
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.70
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride?
The IUPAC name of cyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride (CID 162343507) is cyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride.
What is the SMILES notation for cyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride?
The canonical SMILES for cyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride is Cl.NC(c1nccs1)C1CC1.
What is the InChIKey of cyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride?
The InChIKey is YAIGFVSNDXHJDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2S.ClH/c8-6(5-1-2-5)7-9-3-4-10-7;/h3-6H,1-2,8H2;1H.
What are the key properties of cyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride?
cyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride has a molecular weight of 190.70 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl(1,3-thiazol-2-yl)methanamine;hydrochloride is sourced from PubChem (CID 162343507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).