3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine

C14H18N4O — CID 105191007

IUPAC3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine
SMILESCOc1ccc(C(Cc2cnccc2N)NN)cc1
InChIInChI=1S/C14H18N4O/c1-19-12-4-2-10(3-5-12)14(18-16)8-11-9-17-7-6-13(11)15/h2-7,9,14,18H,8,16H2,1H3,(H2,15,17)
InChIKeyPGVFVQADQWTHIF-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.42
Rot. Bonds5

About 3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine

3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine (PubChem CID 105191007) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine.

Molecular Properties

Compound Name3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine
PubChem CID105191007
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine
SMILESCOc1ccc(C(Cc2cnccc2N)NN)cc1
InChIInChI=1S/C14H18N4O/c1-19-12-4-2-10(3-5-12)14(18-16)8-11-9-17-7-6-13(11)15/h2-7,9,14,18H,8,16H2,1H3,(H2,15,17)
InChIKeyPGVFVQADQWTHIF-UHFFFAOYSA-N
XLogP1.42
TPSA86.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.42
H-Bond Donors ≤ 53
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 3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine?
The IUPAC name of 3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine (CID 105191007) is 3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine.
What is the SMILES notation for 3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine?
The canonical SMILES for 3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine is COc1ccc(C(Cc2cnccc2N)NN)cc1.
What is the InChIKey of 3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine?
The InChIKey is PGVFVQADQWTHIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-19-12-4-2-10(3-5-12)14(18-16)8-11-9-17-7-6-13(11)15/h2-7,9,14,18H,8,16H2,1H3,(H2,15,17).
What are the key properties of 3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine?
3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine has a molecular weight of 258.32 g/mol, XLogP of 1.42, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine is sourced from PubChem (CID 105191007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).