[6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine

C13H17N5 — CID 63559686

IUPAC[6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine
SMILESCCc1nc(Cc2cccnc2)nc(NN)c1C
InChIInChI=1S/C13H17N5/c1-3-11-9(2)13(18-14)17-12(16-11)7-10-5-4-6-15-8-10/h4-6,8H,3,7,14H2,1-2H3,(H,16,17,18)
InChIKeySRIUCQRCUFUUCT-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.62
Rot. Bonds4

About [6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine

[6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine (PubChem CID 63559686) has the molecular formula C13H17N5 and a molecular weight of 243.31 g/mol. Its IUPAC name is [6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine
PubChem CID63559686
Molecular FormulaC13H17N5
Molecular Weight243.31 g/mol
Exact Mass243.15
IUPAC Name[6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine
SMILESCCc1nc(Cc2cccnc2)nc(NN)c1C
InChIInChI=1S/C13H17N5/c1-3-11-9(2)13(18-14)17-12(16-11)7-10-5-4-6-15-8-10/h4-6,8H,3,7,14H2,1-2H3,(H,16,17,18)
InChIKeySRIUCQRCUFUUCT-UHFFFAOYSA-N
XLogP1.62
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine (CID 63559686) is [6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine is CCc1nc(Cc2cccnc2)nc(NN)c1C.
What is the InChIKey of [6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine?
The InChIKey is SRIUCQRCUFUUCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5/c1-3-11-9(2)13(18-14)17-12(16-11)7-10-5-4-6-15-8-10/h4-6,8H,3,7,14H2,1-2H3,(H,16,17,18).
What are the key properties of [6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine?
[6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine has a molecular weight of 243.31 g/mol, XLogP of 1.62, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-ethyl-5-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 63559686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).