6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine

C11H15N5S — CID 80919084

IUPAC6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine
SMILESCc1c(NN)ncnc1NC(C)c1ccsc1
InChIInChI=1S/C11H15N5S/c1-7-10(13-6-14-11(7)16-12)15-8(2)9-3-4-17-5-9/h3-6,8H,12H2,1-2H3,(H2,13,14,15,16)
InChIKeyUZSGAWPTIXCROT-UHFFFAOYSA-N
MW249.34 g/mol
LogP2.31
Rot. Bonds4

About 6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine

6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine (PubChem CID 80919084) has the molecular formula C11H15N5S and a molecular weight of 249.34 g/mol. Its IUPAC name is 6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine
PubChem CID80919084
Molecular FormulaC11H15N5S
Molecular Weight249.34 g/mol
Exact Mass249.10
IUPAC Name6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine
SMILESCc1c(NN)ncnc1NC(C)c1ccsc1
InChIInChI=1S/C11H15N5S/c1-7-10(13-6-14-11(7)16-12)15-8(2)9-3-4-17-5-9/h3-6,8H,12H2,1-2H3,(H2,13,14,15,16)
InChIKeyUZSGAWPTIXCROT-UHFFFAOYSA-N
XLogP2.31
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 52.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine (CID 80919084) is 6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine is Cc1c(NN)ncnc1NC(C)c1ccsc1.
What is the InChIKey of 6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine?
The InChIKey is UZSGAWPTIXCROT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5S/c1-7-10(13-6-14-11(7)16-12)15-8(2)9-3-4-17-5-9/h3-6,8H,12H2,1-2H3,(H2,13,14,15,16).
What are the key properties of 6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine?
6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine has a molecular weight of 249.34 g/mol, XLogP of 2.31, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine is sourced from PubChem (CID 80919084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).