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

C13H20N6S — CID 81006098

IUPAC6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
SMILESCCCc1nc(NN)c(C)c(NC(C)c2nccs2)n1
InChIInChI=1S/C13H20N6S/c1-4-5-10-17-11(8(2)12(18-10)19-14)16-9(3)13-15-6-7-20-13/h6-7,9H,4-5,14H2,1-3H3,(H2,16,17,18,19)
InChIKeyPJIHESJUWNSSOO-UHFFFAOYSA-N
MW292.41 g/mol
LogP2.65
Rot. Bonds6

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

6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine (PubChem CID 81006098) has the molecular formula C13H20N6S and a molecular weight of 292.41 g/mol. Its IUPAC name is 6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
PubChem CID81006098
Molecular FormulaC13H20N6S
Molecular Weight292.41 g/mol
Exact Mass292.15
IUPAC Name6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
SMILESCCCc1nc(NN)c(C)c(NC(C)c2nccs2)n1
InChIInChI=1S/C13H20N6S/c1-4-5-10-17-11(8(2)12(18-10)19-14)16-9(3)13-15-6-7-20-13/h6-7,9H,4-5,14H2,1-3H3,(H2,16,17,18,19)
InChIKeyPJIHESJUWNSSOO-UHFFFAOYSA-N
XLogP2.65
TPSA88.75 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.41
LogP ≤ 52.65
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

2-propyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
CID 80949949
N-(3,3-dimethylbutan-2-yl)-6-hydrazinyl-5-methyl-2-propylpyrimidin-4-amine
CID 113458137
6-N-ethyl-5-propyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
CID 80845106
6-hydrazinyl-5-methyl-N-(4-methylhexan-2-yl)-2-propylpyrimidin-4-amine
CID 81007165
6-hydrazinyl-5-methyl-2-propyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrimidin-4-amine
CID 80994648
1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine
CID 81006767
6-hydrazinyl-5-methyl-N-[(3-methylthiophen-2-yl)methyl]-2-propylpyrimidin-4-amine
CID 81007066
6-hydrazinyl-5-methyl-N-(2-methylpropyl)-2-propylpyrimidin-4-amine
CID 81001135
2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
CID 80984821
6-hydrazinyl-2-methyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
CID 80917620
N-(1-cyclohexylethyl)-6-hydrazinyl-5-methyl-2-propylpyrimidin-4-amine
CID 81007115
2-ethyl-6-hydrazinyl-5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
CID 81007235

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine (CID 81006098) is 6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine is CCCc1nc(NN)c(C)c(NC(C)c2nccs2)n1.
What is the InChIKey of 6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine?
The InChIKey is PJIHESJUWNSSOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6S/c1-4-5-10-17-11(8(2)12(18-10)19-14)16-9(3)13-15-6-7-20-13/h6-7,9H,4-5,14H2,1-3H3,(H2,16,17,18,19).
What are the key properties of 6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine?
6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine has a molecular weight of 292.41 g/mol, XLogP of 2.65, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-5-methyl-2-propyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine is sourced from PubChem (CID 81006098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).