N'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide

C17H19N3O4 — CID 25161830

IUPACN'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide
SMILESCCOc1ccc(OCCC(=O)NNC(=O)c2ccncc2)cc1
InChIInChI=1S/C17H19N3O4/c1-2-23-14-3-5-15(6-4-14)24-12-9-16(21)19-20-17(22)13-7-10-18-11-8-13/h3-8,10-11H,2,9,12H2,1H3,(H,19,21)(H,20,22)
InChIKeySRKGZKTXQRDDRN-UHFFFAOYSA-N
MW329.36 g/mol
LogP1.71
Rot. Bonds7

About N'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide

N'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide (PubChem CID 25161830) has the molecular formula C17H19N3O4 and a molecular weight of 329.36 g/mol. Its IUPAC name is N'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide.

Molecular Properties

Compound NameN'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide
PubChem CID25161830
Molecular FormulaC17H19N3O4
Molecular Weight329.36 g/mol
Exact Mass329.14
IUPAC NameN'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide
SMILESCCOc1ccc(OCCC(=O)NNC(=O)c2ccncc2)cc1
InChIInChI=1S/C17H19N3O4/c1-2-23-14-3-5-15(6-4-14)24-12-9-16(21)19-20-17(22)13-7-10-18-11-8-13/h3-8,10-11H,2,9,12H2,1H3,(H,19,21)(H,20,22)
InChIKeySRKGZKTXQRDDRN-UHFFFAOYSA-N
XLogP1.71
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-[(E)-(4-methoxyphenyl)methylidene]pyridine-4-carbohydrazide
CID 5390727
2-Phenoxynicotinohydrazide
CID 2797685
N-[(E)-(4-oxochromen-3-yl)methylideneamino]pyridine-4-carboxamide
CID 6897208
N'-(2-methoxybenzylidene)isonicotinohydrazide
CID 9568164
Isonicotinic acid 4-hexyloxy-phenyl ester
CID 3119481
N'-(4-phenoxybutanoyl)pyridine-4-carbohydrazide
CID 4780082
N'-[4-(3-methylphenoxy)butanoyl]pyridine-2-carbohydrazide
CID 4790014
N'-[4-(4-methylphenoxy)butanoyl]pyridine-2-carbohydrazide
CID 4790015
N-[(Z)-(3-carbamoylchromen-2-ylidene)amino]pyridine-4-carboxamide
CID 5378362
2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide
CID 6898614
N'-[(E)-(2-methyl-2H-chromen-3-yl)methylidene]pyridine-4-carbohydrazide
CID 9677865
N'-[3-(2,5-dimethylphenoxy)propanoyl]pyridine-4-carbohydrazide
CID 24980002

Frequently Asked Questions

What is the IUPAC name of N'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide?
The IUPAC name of N'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide (CID 25161830) is N'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide.
What is the SMILES notation for N'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide?
The canonical SMILES for N'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide is CCOc1ccc(OCCC(=O)NNC(=O)c2ccncc2)cc1.
What is the InChIKey of N'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide?
The InChIKey is SRKGZKTXQRDDRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O4/c1-2-23-14-3-5-15(6-4-14)24-12-9-16(21)19-20-17(22)13-7-10-18-11-8-13/h3-8,10-11H,2,9,12H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide?
N'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide has a molecular weight of 329.36 g/mol, XLogP of 1.71, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[3-(4-ethoxyphenoxy)propanoyl]pyridine-4-carbohydrazide is sourced from PubChem (CID 25161830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).