5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine

C11H16N6S — CID 80909420

IUPAC5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine
SMILESCCc1c(NN)ncnc1NCCc1cscn1
InChIInChI=1S/C11H16N6S/c1-2-9-10(14-6-15-11(9)17-12)13-4-3-8-5-18-7-16-8/h5-7H,2-4,12H2,1H3,(H2,13,14,15,17)
InChIKeyXFYVLOVDGCEGIA-UHFFFAOYSA-N
MW264.36 g/mol
LogP1.44
Rot. Bonds6

About 5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine

5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine (PubChem CID 80909420) has the molecular formula C11H16N6S and a molecular weight of 264.36 g/mol. Its IUPAC name is 5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine
PubChem CID80909420
Molecular FormulaC11H16N6S
Molecular Weight264.36 g/mol
Exact Mass264.12
IUPAC Name5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine
SMILESCCc1c(NN)ncnc1NCCc1cscn1
InChIInChI=1S/C11H16N6S/c1-2-9-10(14-6-15-11(9)17-12)13-4-3-8-5-18-7-16-8/h5-7H,2-4,12H2,1H3,(H2,13,14,15,17)
InChIKeyXFYVLOVDGCEGIA-UHFFFAOYSA-N
XLogP1.44
TPSA88.75 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.36
LogP ≤ 51.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-chloro-5-ethyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine
CID 63826299
5-propyl-4-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidine-4,6-diamine
CID 80846566
6-hydrazinyl-5-methyl-2-propan-2-yl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine
CID 81007615
5-ethyl-6-hydrazinyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyrimidin-4-amine
CID 106424754
N-(2-cyclopropylethyl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80924360
5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol
CID 106138738
4,5-dimethyl-2-N-[2-(1,3-thiazol-4-yl)ethyl]benzene-1,2-diamine
CID 114281261
2-[2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethoxy]ethanol
CID 80918817
2-hydrazinyl-6-methyl-5-nitro-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine
CID 114045044
6-hydrazinyl-2-methylsulfanyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine
CID 80910991
1-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]propan-2-ol
CID 80906559
4-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]-1-methoxybutan-2-ol
CID 106249039

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine?
The IUPAC name of 5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine (CID 80909420) is 5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine?
The canonical SMILES for 5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine is CCc1c(NN)ncnc1NCCc1cscn1.
What is the InChIKey of 5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine?
The InChIKey is XFYVLOVDGCEGIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6S/c1-2-9-10(14-6-15-11(9)17-12)13-4-3-8-5-18-7-16-8/h5-7H,2-4,12H2,1H3,(H2,13,14,15,17).
What are the key properties of 5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine?
5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine has a molecular weight of 264.36 g/mol, XLogP of 1.44, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine is sourced from PubChem (CID 80909420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).