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

C15H25N3S — CID 103360618

IUPAC5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine
SMILESCC(C)(C)C1CCN(c2snc(N)c2C2CC2)CC1
InChIInChI=1S/C15H25N3S/c1-15(2,3)11-6-8-18(9-7-11)14-12(10-4-5-10)13(16)17-19-14/h10-11H,4-9H2,1-3H3,(H2,16,17)
InChIKeyMKMBJOHMTXGKJA-UHFFFAOYSA-N
MW279.45 g/mol
LogP3.87
Rot. Bonds2

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

5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine (PubChem CID 103360618) has the molecular formula C15H25N3S and a molecular weight of 279.45 g/mol. Its IUPAC name is 5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine.

Molecular Properties

Compound Name5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine
PubChem CID103360618
Molecular FormulaC15H25N3S
Molecular Weight279.45 g/mol
Exact Mass279.18
IUPAC Name5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine
SMILESCC(C)(C)C1CCN(c2snc(N)c2C2CC2)CC1
InChIInChI=1S/C15H25N3S/c1-15(2,3)11-6-8-18(9-7-11)14-12(10-4-5-10)13(16)17-19-14/h10-11H,4-9H2,1-3H3,(H2,16,17)
InChIKeyMKMBJOHMTXGKJA-UHFFFAOYSA-N
XLogP3.87
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.45
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine?
The IUPAC name of 5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine (CID 103360618) is 5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine.
What is the SMILES notation for 5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine?
The canonical SMILES for 5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine is CC(C)(C)C1CCN(c2snc(N)c2C2CC2)CC1.
What is the InChIKey of 5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine?
The InChIKey is MKMBJOHMTXGKJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3S/c1-15(2,3)11-6-8-18(9-7-11)14-12(10-4-5-10)13(16)17-19-14/h10-11H,4-9H2,1-3H3,(H2,16,17).
What are the key properties of 5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine?
5-(4-tert-butylpiperidin-1-yl)-4-cyclopropyl-1,2-thiazol-3-amine has a molecular weight of 279.45 g/mol, XLogP of 3.87, 2 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-cyclopropyl-1,2-thiazol-3-amine is sourced from PubChem (CID 103360618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).