N-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine

C13H25N3S — CID 113492518

IUPACN-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC(C)C1CN=C(NC2CCN(C)C(C)C2)S1
InChIInChI=1S/C13H25N3S/c1-9(2)12-8-14-13(17-12)15-11-5-6-16(4)10(3)7-11/h9-12H,5-8H2,1-4H3,(H,14,15)
InChIKeyBSLJGDUCZUGQNF-UHFFFAOYSA-N
MW255.43 g/mol
LogP2.19
Rot. Bonds2

About N-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine

N-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 113492518) has the molecular formula C13H25N3S and a molecular weight of 255.43 g/mol. Its IUPAC name is N-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID113492518
Molecular FormulaC13H25N3S
Molecular Weight255.43 g/mol
Exact Mass255.18
IUPAC NameN-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC(C)C1CN=C(NC2CCN(C)C(C)C2)S1
InChIInChI=1S/C13H25N3S/c1-9(2)12-8-14-13(17-12)15-11-5-6-16(4)10(3)7-11/h9-12H,5-8H2,1-4H3,(H,14,15)
InChIKeyBSLJGDUCZUGQNF-UHFFFAOYSA-N
XLogP2.19
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.43
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine (CID 113492518) is N-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine is CC(C)C1CN=C(NC2CCN(C)C(C)C2)S1.
What is the InChIKey of N-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is BSLJGDUCZUGQNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3S/c1-9(2)12-8-14-13(17-12)15-11-5-6-16(4)10(3)7-11/h9-12H,5-8H2,1-4H3,(H,14,15).
What are the key properties of N-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine?
N-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 255.43 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-dimethylpiperidin-4-yl)-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 113492518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).