(6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine

C14H25N3O — CID 103026633

IUPAC(6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine
SMILESCOC(C)(C)CCC(CCc1cccnc1)NN
InChIInChI=1S/C14H25N3O/c1-14(2,18-3)9-8-13(17-15)7-6-12-5-4-10-16-11-12/h4-5,10-11,13,17H,6-9,15H2,1-3H3
InChIKeyKYSGFDXKOXIKCO-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.05
Rot. Bonds8

About (6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine

(6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine (PubChem CID 103026633) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is (6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine.

Molecular Properties

Compound Name(6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine
PubChem CID103026633
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name(6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine
SMILESCOC(C)(C)CCC(CCc1cccnc1)NN
InChIInChI=1S/C14H25N3O/c1-14(2,18-3)9-8-13(17-15)7-6-12-5-4-10-16-11-12/h4-5,10-11,13,17H,6-9,15H2,1-3H3
InChIKeyKYSGFDXKOXIKCO-UHFFFAOYSA-N
XLogP2.05
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine?
The IUPAC name of (6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine (CID 103026633) is (6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine.
What is the SMILES notation for (6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine?
The canonical SMILES for (6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine is COC(C)(C)CCC(CCc1cccnc1)NN.
What is the InChIKey of (6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine?
The InChIKey is KYSGFDXKOXIKCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-14(2,18-3)9-8-13(17-15)7-6-12-5-4-10-16-11-12/h4-5,10-11,13,17H,6-9,15H2,1-3H3.
What are the key properties of (6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine?
(6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine has a molecular weight of 251.37 g/mol, XLogP of 2.05, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxy-6-methyl-1-pyridin-3-ylheptan-3-yl)hydrazine is sourced from PubChem (CID 103026633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).