4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine

C14H19N5S — CID 175662288

IUPAC4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine
SMILESCc1nc(Nc2nc(C)c(C)s2)cc(C2CCNC2)n1
InChIInChI=1S/C14H19N5S/c1-8-9(2)20-14(16-8)19-13-6-12(17-10(3)18-13)11-4-5-15-7-11/h6,11,15H,4-5,7H2,1-3H3,(H,16,17,18,19)
InChIKeyZKCNURBVWFVUFI-UHFFFAOYSA-N
MW289.41 g/mol
LogP2.68
Rot. Bonds3

About 4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine

4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine (PubChem CID 175662288) has the molecular formula C14H19N5S and a molecular weight of 289.41 g/mol. Its IUPAC name is 4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine
PubChem CID175662288
Molecular FormulaC14H19N5S
Molecular Weight289.41 g/mol
Exact Mass289.14
IUPAC Name4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine
SMILESCc1nc(Nc2nc(C)c(C)s2)cc(C2CCNC2)n1
InChIInChI=1S/C14H19N5S/c1-8-9(2)20-14(16-8)19-13-6-12(17-10(3)18-13)11-4-5-15-7-11/h6,11,15H,4-5,7H2,1-3H3,(H,16,17,18,19)
InChIKeyZKCNURBVWFVUFI-UHFFFAOYSA-N
XLogP2.68
TPSA62.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.41
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4,5-dimethyl-N-[2-methyl-6-[(3S)-1-propan-2-ylpyrrolidin-3-yl]pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 124952376
2-methyl-N-pyrimidin-2-yl-6-pyrrolidin-3-ylpyrimidin-4-amine
CID 110095196
4,5-dimethyl-N-[6-methyl-2-[(3S)-piperidin-3-yl]pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 124978971
N-(2-methyl-6-piperidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine
CID 66509318
N-[6-(azetidin-3-yl)-2-methylpyrimidin-4-yl]-4-methyl-1,3-thiazol-2-amine
CID 175659929
(E)-1-[3-[6-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-methylpyrimidin-4-yl]piperidin-1-yl]-3-phenylprop-2-en-1-one
CID 132766865
(3R)-N-(4,5-dimethyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide
CID 94916867
4,5-dimethyl-N-(6-morpholin-2-yl-2-pyridinyl)-1,3-thiazol-2-amine
CID 110093236
4-methyl-N-(6-methyl-2-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine
CID 110095024
4,5-dimethyl-N-[6-methyl-2-(1-methylpiperidin-3-yl)pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 110095386
5-methyl-N-[2-methyl-6-[(2R)-pyrrolidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine
CID 95842001
5-methyl-N-(6-methyl-2-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine
CID 155985242

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine (CID 175662288) is 4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine is Cc1nc(Nc2nc(C)c(C)s2)cc(C2CCNC2)n1.
What is the InChIKey of 4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine?
The InChIKey is ZKCNURBVWFVUFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5S/c1-8-9(2)20-14(16-8)19-13-6-12(17-10(3)18-13)11-4-5-15-7-11/h6,11,15H,4-5,7H2,1-3H3,(H,16,17,18,19).
What are the key properties of 4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine?
4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine has a molecular weight of 289.41 g/mol, XLogP of 2.68, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-N-(2-methyl-6-pyrrolidin-3-ylpyrimidin-4-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 175662288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).