5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine

C13H23N3S — CID 103360617

IUPAC5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine
SMILESCc1c(N)nsc1N1CCC(C(C)(C)C)CC1
InChIInChI=1S/C13H23N3S/c1-9-11(14)15-17-12(9)16-7-5-10(6-8-16)13(2,3)4/h10H,5-8H2,1-4H3,(H2,14,15)
InChIKeyRBRCSLDDQFTOEI-UHFFFAOYSA-N
MW253.41 g/mol
LogP3.30
Rot. Bonds1

About 5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine

5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine (PubChem CID 103360617) has the molecular formula C13H23N3S and a molecular weight of 253.41 g/mol. Its IUPAC name is 5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine.

Molecular Properties

Compound Name5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine
PubChem CID103360617
Molecular FormulaC13H23N3S
Molecular Weight253.41 g/mol
Exact Mass253.16
IUPAC Name5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine
SMILESCc1c(N)nsc1N1CCC(C(C)(C)C)CC1
InChIInChI=1S/C13H23N3S/c1-9-11(14)15-17-12(9)16-7-5-10(6-8-16)13(2,3)4/h10H,5-8H2,1-4H3,(H2,14,15)
InChIKeyRBRCSLDDQFTOEI-UHFFFAOYSA-N
XLogP3.30
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.41
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine
CID 103360618
5-(4-tert-butylpiperidin-1-yl)-4-methylsulfonyl-1,2-thiazol-3-amine
CID 103379610
3-amino-5-(4-tert-butylpiperidin-1-yl)-N-methyl-1,2-thiazole-4-carboxamide
CID 103379615
4-methyl-5-(3-propan-2-ylpyrrolidin-1-yl)-1,2-thiazol-3-amine
CID 103365241
5-(1,1-dioxo-1,4-thiazinan-4-yl)-4-methyl-1,2-thiazol-3-amine
CID 103360525
4-methyl-5-(1,4-thiazepan-4-yl)-1,2-thiazol-3-amine
CID 103361831
[1-(3-amino-4-methyl-1,2-thiazol-5-yl)piperidin-3-yl]methanol
CID 103361986
5-(3,3-difluoropyrrolidin-1-yl)-4-methyl-1,2-thiazol-3-amine
CID 131115596
5-(3-ethoxypiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine
CID 103361875
4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine
CID 103362422
6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80984837
3-amino-N-methyl-5-[4-(trifluoromethyl)piperidin-1-yl]-1,2-thiazole-4-carboxamide
CID 103382179

Frequently Asked Questions

What is the IUPAC name of 5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine?
The IUPAC name of 5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine (CID 103360617) is 5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine.
What is the SMILES notation for 5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine?
The canonical SMILES for 5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine is Cc1c(N)nsc1N1CCC(C(C)(C)C)CC1.
What is the InChIKey of 5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine?
The InChIKey is RBRCSLDDQFTOEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3S/c1-9-11(14)15-17-12(9)16-7-5-10(6-8-16)13(2,3)4/h10H,5-8H2,1-4H3,(H2,14,15).
What are the key properties of 5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine?
5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine has a molecular weight of 253.41 g/mol, XLogP of 3.30, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine is sourced from PubChem (CID 103360617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).