3-(4-propoxyindol-1-yl)propanehydrazide

C14H19N3O2 — CID 83162357

IUPAC3-(4-propoxyindol-1-yl)propanehydrazide
SMILESCCCOc1cccc2c1ccn2CCC(=O)NN
InChIInChI=1S/C14H19N3O2/c1-2-10-19-13-5-3-4-12-11(13)6-8-17(12)9-7-14(18)16-15/h3-6,8H,2,7,9-10,15H2,1H3,(H,16,18)
InChIKeySZHZUSLQDMEPPM-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.81
Rot. Bonds6

About 3-(4-propoxyindol-1-yl)propanehydrazide

3-(4-propoxyindol-1-yl)propanehydrazide (PubChem CID 83162357) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 3-(4-propoxyindol-1-yl)propanehydrazide.

Molecular Properties

Compound Name3-(4-propoxyindol-1-yl)propanehydrazide
PubChem CID83162357
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name3-(4-propoxyindol-1-yl)propanehydrazide
SMILESCCCOc1cccc2c1ccn2CCC(=O)NN
InChIInChI=1S/C14H19N3O2/c1-2-10-19-13-5-3-4-12-11(13)6-8-17(12)9-7-14(18)16-15/h3-6,8H,2,7,9-10,15H2,1H3,(H,16,18)
InChIKeySZHZUSLQDMEPPM-UHFFFAOYSA-N
XLogP1.81
TPSA69.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', '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-3-(4-propoxyindol-1-yl)propanamide
CID 83174183
2-(4-propoxyindol-1-yl)acetohydrazide
CID 83163365
3-(4-propoxyindol-1-yl)propanamide
CID 83173818
3-(4-propoxyindol-1-yl)propanoic acid
CID 83163575
3-(4-propoxyindol-1-yl)propan-1-amine
CID 83163339
4-propoxy-1-(2-propoxyethyl)indole
CID 106458022
1-(2-ethylsulfonylethyl)-4-propoxyindole
CID 83174266
1-(3-ethoxypropyl)-4-propoxyindole
CID 83173539
1-(3-methylsulfonylpropyl)-4-propoxyindole
CID 83173638
3-(4-cyanoindol-1-yl)propanehydrazide
CID 107919610
2-methyl-N-[2-(4-propoxyindol-1-yl)ethyl]propan-1-amine
CID 83163124
2-methyl-N-[2-(4-propoxyindol-1-yl)ethyl]butan-2-amine
CID 83164938

Frequently Asked Questions

What is the IUPAC name of 3-(4-propoxyindol-1-yl)propanehydrazide?
The IUPAC name of 3-(4-propoxyindol-1-yl)propanehydrazide (CID 83162357) is 3-(4-propoxyindol-1-yl)propanehydrazide.
What is the SMILES notation for 3-(4-propoxyindol-1-yl)propanehydrazide?
The canonical SMILES for 3-(4-propoxyindol-1-yl)propanehydrazide is CCCOc1cccc2c1ccn2CCC(=O)NN.
What is the InChIKey of 3-(4-propoxyindol-1-yl)propanehydrazide?
The InChIKey is SZHZUSLQDMEPPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-2-10-19-13-5-3-4-12-11(13)6-8-17(12)9-7-14(18)16-15/h3-6,8H,2,7,9-10,15H2,1H3,(H,16,18).
What are the key properties of 3-(4-propoxyindol-1-yl)propanehydrazide?
3-(4-propoxyindol-1-yl)propanehydrazide has a molecular weight of 261.32 g/mol, XLogP of 1.81, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-propoxyindol-1-yl)propanehydrazide is sourced from PubChem (CID 83162357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).