1-(2-methylpyrimidin-4-yl)undecylhydrazine

C16H30N4 — CID 105260655

IUPAC1-(2-methylpyrimidin-4-yl)undecylhydrazine
SMILESCCCCCCCCCCC(NN)c1ccnc(C)n1
InChIInChI=1S/C16H30N4/c1-3-4-5-6-7-8-9-10-11-16(20-17)15-12-13-18-14(2)19-15/h12-13,16,20H,3-11,17H2,1-2H3
InChIKeyXITHCQVXLQZSEC-UHFFFAOYSA-N
MW278.44 g/mol
LogP3.82
Rot. Bonds11

About 1-(2-methylpyrimidin-4-yl)undecylhydrazine

1-(2-methylpyrimidin-4-yl)undecylhydrazine (PubChem CID 105260655) has the molecular formula C16H30N4 and a molecular weight of 278.44 g/mol. Its IUPAC name is 1-(2-methylpyrimidin-4-yl)undecylhydrazine.

Molecular Properties

Compound Name1-(2-methylpyrimidin-4-yl)undecylhydrazine
PubChem CID105260655
Molecular FormulaC16H30N4
Molecular Weight278.44 g/mol
Exact Mass278.25
IUPAC Name1-(2-methylpyrimidin-4-yl)undecylhydrazine
SMILESCCCCCCCCCCC(NN)c1ccnc(C)n1
InChIInChI=1S/C16H30N4/c1-3-4-5-6-7-8-9-10-11-16(20-17)15-12-13-18-14(2)19-15/h12-13,16,20H,3-11,17H2,1-2H3
InChIKeyXITHCQVXLQZSEC-UHFFFAOYSA-N
XLogP3.82
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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Related Compounds

N-methyl-1-(2-methylpyrimidin-4-yl)nonan-1-amine
CID 115530489
N-ethyl-1-(2-methylpyrimidin-4-yl)heptan-1-amine
CID 113329619
1-(2-methylpyrimidin-4-yl)octan-1-ol
CID 115527924
1-(2-methylpyrimidin-4-yl)tridecan-1-ol
CID 115528032
1-pyrimidin-4-yldecylhydrazine
CID 105220997
1-pyridin-2-yloctylhydrazine
CID 105195796
[2-methoxy-1-(2-methylpyrimidin-4-yl)ethyl]hydrazine
CID 105260599
1-pyrazin-2-yltridecylhydrazine
CID 105203302
1-[5-(trifluoromethyl)-2-pyridinyl]nonylhydrazine
CID 105294404
1-pyridin-4-ylheptylhydrazine
CID 105196555
1-(2,6-dimethyl-3-pyridinyl)heptylhydrazine
CID 105293944
1-(1,3-thiazol-4-yl)decylhydrazine
CID 105254386

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpyrimidin-4-yl)undecylhydrazine?
The IUPAC name of 1-(2-methylpyrimidin-4-yl)undecylhydrazine (CID 105260655) is 1-(2-methylpyrimidin-4-yl)undecylhydrazine.
What is the SMILES notation for 1-(2-methylpyrimidin-4-yl)undecylhydrazine?
The canonical SMILES for 1-(2-methylpyrimidin-4-yl)undecylhydrazine is CCCCCCCCCCC(NN)c1ccnc(C)n1.
What is the InChIKey of 1-(2-methylpyrimidin-4-yl)undecylhydrazine?
The InChIKey is XITHCQVXLQZSEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4/c1-3-4-5-6-7-8-9-10-11-16(20-17)15-12-13-18-14(2)19-15/h12-13,16,20H,3-11,17H2,1-2H3.
What are the key properties of 1-(2-methylpyrimidin-4-yl)undecylhydrazine?
1-(2-methylpyrimidin-4-yl)undecylhydrazine has a molecular weight of 278.44 g/mol, XLogP of 3.82, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpyrimidin-4-yl)undecylhydrazine is sourced from PubChem (CID 105260655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).