[1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine

C16H19N3O — CID 105212080

IUPAC[1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine
SMILESNNC(Cc1cccnc1)c1ccc(OC2CC2)cc1
InChIInChI=1S/C16H19N3O/c17-19-16(10-12-2-1-9-18-11-12)13-3-5-14(6-4-13)20-15-7-8-15/h1-6,9,11,15-16,19H,7-8,10,17H2
InChIKeyALIQKLVQSCXNPB-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.37
Rot. Bonds6

About [1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine

[1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine (PubChem CID 105212080) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is [1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine
PubChem CID105212080
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name[1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine
SMILESNNC(Cc1cccnc1)c1ccc(OC2CC2)cc1
InChIInChI=1S/C16H19N3O/c17-19-16(10-12-2-1-9-18-11-12)13-3-5-14(6-4-13)20-15-7-8-15/h1-6,9,11,15-16,19H,7-8,10,17H2
InChIKeyALIQKLVQSCXNPB-UHFFFAOYSA-N
XLogP2.37
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.37
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 [1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine?
The IUPAC name of [1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine (CID 105212080) is [1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine.
What is the SMILES notation for [1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine?
The canonical SMILES for [1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine is NNC(Cc1cccnc1)c1ccc(OC2CC2)cc1.
What is the InChIKey of [1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine?
The InChIKey is ALIQKLVQSCXNPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c17-19-16(10-12-2-1-9-18-11-12)13-3-5-14(6-4-13)20-15-7-8-15/h1-6,9,11,15-16,19H,7-8,10,17H2.
What are the key properties of [1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine?
[1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine has a molecular weight of 269.35 g/mol, XLogP of 2.37, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine is sourced from PubChem (CID 105212080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).