2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine

C14H27N5 — CID 107819142

IUPAC2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine
SMILESCc1cnc(NN)nc1NCCCCCCC(C)C
InChIInChI=1S/C14H27N5/c1-11(2)8-6-4-5-7-9-16-13-12(3)10-17-14(18-13)19-15/h10-11H,4-9,15H2,1-3H3,(H2,16,17,18,19)
InChIKeyAHEMSBMPYYEUMF-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.09
Rot. Bonds9

About 2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine

2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine (PubChem CID 107819142) has the molecular formula C14H27N5 and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine
PubChem CID107819142
Molecular FormulaC14H27N5
Molecular Weight265.40 g/mol
Exact Mass265.23
IUPAC Name2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine
SMILESCc1cnc(NN)nc1NCCCCCCC(C)C
InChIInChI=1S/C14H27N5/c1-11(2)8-6-4-5-7-9-16-13-12(3)10-17-14(18-13)19-15/h10-11H,4-9,15H2,1-3H3,(H2,16,17,18,19)
InChIKeyAHEMSBMPYYEUMF-UHFFFAOYSA-N
XLogP3.09
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine?
The IUPAC name of 2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine (CID 107819142) is 2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine.
What is the SMILES notation for 2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine?
The canonical SMILES for 2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine is Cc1cnc(NN)nc1NCCCCCCC(C)C.
What is the InChIKey of 2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine?
The InChIKey is AHEMSBMPYYEUMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N5/c1-11(2)8-6-4-5-7-9-16-13-12(3)10-17-14(18-13)19-15/h10-11H,4-9,15H2,1-3H3,(H2,16,17,18,19).
What are the key properties of 2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine?
2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine has a molecular weight of 265.40 g/mol, XLogP of 3.09, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-5-methyl-N-(7-methyloctyl)pyrimidin-4-amine is sourced from PubChem (CID 107819142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).