2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine

C14H19N5S — CID 80984821

IUPAC2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
SMILESCNc1nc(C2CC2)nc(NC(C)c2nccs2)c1C
InChIInChI=1S/C14H19N5S/c1-8-11(15-3)18-13(10-4-5-10)19-12(8)17-9(2)14-16-6-7-20-14/h6-7,9-10H,4-5H2,1-3H3,(H2,15,17,18,19)
InChIKeyFPMAOKVRTIRPRR-UHFFFAOYSA-N
MW289.41 g/mol
LogP3.33
Rot. Bonds5

About 2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine

2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine (PubChem CID 80984821) has the molecular formula C14H19N5S and a molecular weight of 289.41 g/mol. Its IUPAC name is 2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine.

Molecular Properties

Compound Name2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
PubChem CID80984821
Molecular FormulaC14H19N5S
Molecular Weight289.41 g/mol
Exact Mass289.14
IUPAC Name2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
SMILESCNc1nc(C2CC2)nc(NC(C)c2nccs2)c1C
InChIInChI=1S/C14H19N5S/c1-8-11(15-3)18-13(10-4-5-10)19-12(8)17-9(2)14-16-6-7-20-14/h6-7,9-10H,4-5H2,1-3H3,(H2,15,17,18,19)
InChIKeyFPMAOKVRTIRPRR-UHFFFAOYSA-N
XLogP3.33
TPSA62.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.41
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine with MolForge

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Related Compounds

2-cyclopropyl-6-N,5-dimethyl-4-N-(1-thiophen-3-ylethyl)pyrimidine-4,6-diamine
CID 80983342
6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
CID 81006098
4-N-cyclohexyl-2-cyclopropyl-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80980958
4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol
CID 80992975
2-cyclopropyl-4-N-[(3-ethylthiophen-2-yl)methyl]-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80992318
N-[1-(1,3-thiazol-2-yl)ethyl]-1,3-thiazol-2-amine
CID 63612751
2-cyclopropyl-N,5-dimethyl-6-pyrazin-2-ylpyrimidin-4-amine
CID 80976398
2-cyclopropyl-N,5-dimethyl-6-propan-2-yloxypyrimidin-4-amine
CID 80988574
2-cyclopropyl-6-hydrazinyl-5-methyl-N-propan-2-ylpyrimidin-4-amine
CID 81000903
6-N-methyl-8-N-[1-(1,3-thiazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80844042
6-N-methyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
CID 80844662
5,6-dimethyl-3-[1-(1,3-thiazol-2-yl)ethylamino]pyridazine-4-carbonitrile
CID 63613595

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine?
The IUPAC name of 2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine (CID 80984821) is 2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine.
What is the SMILES notation for 2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine?
The canonical SMILES for 2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine is CNc1nc(C2CC2)nc(NC(C)c2nccs2)c1C.
What is the InChIKey of 2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine?
The InChIKey is FPMAOKVRTIRPRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5S/c1-8-11(15-3)18-13(10-4-5-10)19-12(8)17-9(2)14-16-6-7-20-14/h6-7,9-10H,4-5H2,1-3H3,(H2,15,17,18,19).
What are the key properties of 2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine?
2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine has a molecular weight of 289.41 g/mol, XLogP of 3.33, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine is sourced from PubChem (CID 80984821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).