4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine

C13H23N3S — CID 61334576

IUPAC4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine
SMILESCCCNC1(c2nc(C)c(C)s2)CCNCC1
InChIInChI=1S/C13H23N3S/c1-4-7-15-13(5-8-14-9-6-13)12-16-10(2)11(3)17-12/h14-15H,4-9H2,1-3H3
InChIKeyQSCGEBZRKAHWTR-UHFFFAOYSA-N
MW253.41 g/mol
LogP2.34
Rot. Bonds4

About 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine

4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine (PubChem CID 61334576) has the molecular formula C13H23N3S and a molecular weight of 253.41 g/mol. Its IUPAC name is 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine
PubChem CID61334576
Molecular FormulaC13H23N3S
Molecular Weight253.41 g/mol
Exact Mass253.16
IUPAC Name4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine
SMILESCCCNC1(c2nc(C)c(C)s2)CCNCC1
InChIInChI=1S/C13H23N3S/c1-4-7-15-13(5-8-14-9-6-13)12-16-10(2)11(3)17-12/h14-15H,4-9H2,1-3H3
InChIKeyQSCGEBZRKAHWTR-UHFFFAOYSA-N
XLogP2.34
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.41
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propyl-3-(trifluoromethyl)cyclohexan-1-amine
CID 64757627
4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine
CID 61336145
1-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methyl-N-propylcyclopentan-1-amine
CID 65045313
4-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethyl-N-(2-methoxyethyl)azepan-4-amine
CID 65077598
1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylcyclobutan-1-amine
CID 61331332
1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methyl-4-propylcyclohexan-1-amine
CID 61332915
N-cyclopropyl-4-(4,5-dimethyl-1,3-thiazol-2-yl)-3-ethylpiperidin-4-amine
CID 114510212
1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-3,4-dimethylcyclohexan-1-amine
CID 64746457
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 64753485
1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-fluoro-N-propyl-2,3-dihydroinden-1-amine
CID 116531552
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-propylcyclobutan-1-amine
CID 61333808
1-(4,5-dimethyl-1,3-thiazol-2-yl)-4-ethyl-N-propan-2-ylcyclohexan-1-amine
CID 61334626

Frequently Asked Questions

What is the IUPAC name of 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine?
The IUPAC name of 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine (CID 61334576) is 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine.
What is the SMILES notation for 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine?
The canonical SMILES for 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine is CCCNC1(c2nc(C)c(C)s2)CCNCC1.
What is the InChIKey of 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine?
The InChIKey is QSCGEBZRKAHWTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3S/c1-4-7-15-13(5-8-14-9-6-13)12-16-10(2)11(3)17-12/h14-15H,4-9H2,1-3H3.
What are the key properties of 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine?
4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine has a molecular weight of 253.41 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-propylpiperidin-4-amine is sourced from PubChem (CID 61334576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).