1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine

C12H21N3S — CID 115313088

IUPAC1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine
SMILESCc1nc(CN2CCC(N)CC2C)sc1C
InChIInChI=1S/C12H21N3S/c1-8-6-11(13)4-5-15(8)7-12-14-9(2)10(3)16-12/h8,11H,4-7,13H2,1-3H3
InChIKeyYAABXEFZRPWJPO-UHFFFAOYSA-N
MW239.39 g/mol
LogP2.07
Rot. Bonds2

About 1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine

1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine (PubChem CID 115313088) has the molecular formula C12H21N3S and a molecular weight of 239.39 g/mol. Its IUPAC name is 1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine
PubChem CID115313088
Molecular FormulaC12H21N3S
Molecular Weight239.39 g/mol
Exact Mass239.15
IUPAC Name1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine
SMILESCc1nc(CN2CCC(N)CC2C)sc1C
InChIInChI=1S/C12H21N3S/c1-8-6-11(13)4-5-15(8)7-12-14-9(2)10(3)16-12/h8,11H,4-7,13H2,1-3H3
InChIKeyYAABXEFZRPWJPO-UHFFFAOYSA-N
XLogP2.07
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.39
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine 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

[1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-4-methylpiperazin-2-yl]methanamine
CID 80506226
2-[4-methyl-2-[(2-methylpiperidin-1-yl)methyl]-1,3-thiazol-5-yl]propan-2-amine
CID 82427472
2-[(3S)-1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]piperidin-3-yl]ethanamine
CID 124517257
1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-2-methylpiperidin-4-amine
CID 115313227
2-methyl-1-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]piperidin-4-amine
CID 106418175
2-methyl-1-(pyrimidin-4-ylmethyl)piperidin-4-amine
CID 115312023
1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-4-amine
CID 65169125
1-(cyclopenten-1-ylmethyl)-2-methylpiperidin-4-amine
CID 130900846
5-[(2,4-dimethylpiperidin-1-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 80606117
1-[1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]pyrrolidin-2-yl]-2,2,2-trifluoroethanol
CID 84586509
4-[(4-amino-2-methylpiperidin-1-yl)methyl]-3H-1,3-thiazol-2-one
CID 106381551
1-[(1-ethylimidazol-2-yl)methyl]-2-methylpiperidin-4-amine
CID 115313237

Frequently Asked Questions

What is the IUPAC name of 1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine?
The IUPAC name of 1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine (CID 115313088) is 1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine.
What is the SMILES notation for 1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine?
The canonical SMILES for 1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine is Cc1nc(CN2CCC(N)CC2C)sc1C.
What is the InChIKey of 1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine?
The InChIKey is YAABXEFZRPWJPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3S/c1-8-6-11(13)4-5-15(8)7-12-14-9(2)10(3)16-12/h8,11H,4-7,13H2,1-3H3.
What are the key properties of 1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine?
1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine has a molecular weight of 239.39 g/mol, XLogP of 2.07, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methylpiperidin-4-amine is sourced from PubChem (CID 115313088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).