5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride

C12H22ClN3S — CID 120901193

IUPAC5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride
SMILESCCCC1CCCN(Cc2cnc(N)s2)C1.Cl
InChIInChI=1S/C12H21N3S.ClH/c1-2-4-10-5-3-6-15(8-10)9-11-7-14-12(13)16-11;/h7,10H,2-6,8-9H2,1H3,(H2,13,14);1H
InChIKeyRMENAHVEJATOIO-UHFFFAOYSA-N
MW275.85 g/mol
LogP3.16
Rot. Bonds4

About 5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride

5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride (PubChem CID 120901193) has the molecular formula C12H22ClN3S and a molecular weight of 275.85 g/mol. Its IUPAC name is 5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride.

Molecular Properties

Compound Name5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride
PubChem CID120901193
Molecular FormulaC12H22ClN3S
Molecular Weight275.85 g/mol
Exact Mass275.12
IUPAC Name5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride
SMILESCCCC1CCCN(Cc2cnc(N)s2)C1.Cl
InChIInChI=1S/C12H21N3S.ClH/c1-2-4-10-5-3-6-15(8-10)9-11-7-14-12(13)16-11;/h7,10H,2-6,8-9H2,1H3,(H2,13,14);1H
InChIKeyRMENAHVEJATOIO-UHFFFAOYSA-N
XLogP3.16
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.85
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride 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

5-[(4-propylazepan-1-yl)methyl]-1,3-thiazol-2-amine
CID 79772441
5-[(3-propan-2-ylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120903499
5-[(3-tert-butylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine
CID 120905660
[1-[(2-amino-1,3-thiazol-5-yl)methyl]pyrrolidin-3-yl]methanol;hydrochloride
CID 120899572
N-[1-[(2-amino-1,3-thiazol-5-yl)methyl]piperidin-3-yl]butanamide
CID 120899494
5-[[3-(2-ethylimidazol-1-yl)piperidin-1-yl]methyl]-1,3-thiazol-2-amine
CID 120900236
5-[(3-propan-2-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-amine
CID 115883982
1-[(2-amino-1,3-thiazol-5-yl)methyl]-5-propylazepan-2-one
CID 79774182
1-[(2-amino-1,3-thiazol-5-yl)methyl]-N-ethylpyrrolidine-3-sulfonamide;hydrochloride
CID 120902111
5-[[3-(5-methyl-1H-1,2,4-triazol-3-yl)piperidin-1-yl]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120901768
5-[(3-anilinopiperidin-1-yl)methyl]-1,3-thiazol-2-amine
CID 120901186
5-[[3-(4-chlorophenyl)piperidin-1-yl]methyl]-1,3-thiazol-2-amine
CID 131944851

Frequently Asked Questions

What is the IUPAC name of 5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride?
The IUPAC name of 5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride (CID 120901193) is 5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride.
What is the SMILES notation for 5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride?
The canonical SMILES for 5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride is CCCC1CCCN(Cc2cnc(N)s2)C1.Cl.
What is the InChIKey of 5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride?
The InChIKey is RMENAHVEJATOIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3S.ClH/c1-2-4-10-5-3-6-15(8-10)9-11-7-14-12(13)16-11;/h7,10H,2-6,8-9H2,1H3,(H2,13,14);1H.
What are the key properties of 5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride?
5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride has a molecular weight of 275.85 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride is sourced from PubChem (CID 120901193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).