5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine

C11H13N3S — CID 82106824

IUPAC5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine
SMILESCC(C)c1sc(N)nc1-c1cccnc1
InChIInChI=1S/C11H13N3S/c1-7(2)10-9(14-11(12)15-10)8-4-3-5-13-6-8/h3-7H,1-2H3,(H2,12,14)
InChIKeyDMSMOOXAOOBVMT-UHFFFAOYSA-N
MW219.31 g/mol
LogP2.91
Rot. Bonds2

About 5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine

5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine (PubChem CID 82106824) has the molecular formula C11H13N3S and a molecular weight of 219.31 g/mol. Its IUPAC name is 5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine
PubChem CID82106824
Molecular FormulaC11H13N3S
Molecular Weight219.31 g/mol
Exact Mass219.08
IUPAC Name5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine
SMILESCC(C)c1sc(N)nc1-c1cccnc1
InChIInChI=1S/C11H13N3S/c1-7(2)10-9(14-11(12)15-10)8-4-3-5-13-6-8/h3-7H,1-2H3,(H2,12,14)
InChIKeyDMSMOOXAOOBVMT-UHFFFAOYSA-N
XLogP2.91
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-ethylphenyl)-5-propan-2-yl-1,3-thiazol-2-amine
CID 28864528
4-(3,4-difluorophenyl)-5-propan-2-yl-1,3-thiazol-2-amine
CID 82106741
5-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 82186104
bis(2-methylpropane);3-pyridin-3-ylpyridine
CID 158581875
6-methyl-2-pyridin-3-ylpyridin-3-amine
CID 46315250
2-propan-2-yl-6-pyridin-3-ylpyridine
CID 118124535
4-propan-2-yl-6-pyridin-3-yl-5-(trifluoromethyl)pyridin-2-amine
CID 175158320
2-pyridin-3-ylpyridine-3,4-diamine
CID 118914760
(5-methyl-4-pyridin-3-yl-1,3-thiazol-2-yl)methanamine
CID 82106363
2-(2-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-5-yl)acetic acid
CID 82069331
2-ethyl-3-propan-2-yl-5-pyridin-3-ylimidazol-4-amine
CID 62219016
1-methyl-1-(5-pyridin-3-yl-1,3-thiazol-2-yl)hydrazine
CID 142305016

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine?
The IUPAC name of 5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine (CID 82106824) is 5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine?
The canonical SMILES for 5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine is CC(C)c1sc(N)nc1-c1cccnc1.
What is the InChIKey of 5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine?
The InChIKey is DMSMOOXAOOBVMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3S/c1-7(2)10-9(14-11(12)15-10)8-4-3-5-13-6-8/h3-7H,1-2H3,(H2,12,14).
What are the key properties of 5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine?
5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine has a molecular weight of 219.31 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-4-pyridin-3-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 82106824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).