1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea

C15H19N5O2 — CID 144784630

IUPAC1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea
SMILESCCc1cccc(OCc2ccccc2NC(=O)NNN)n1
InChIInChI=1S/C15H19N5O2/c1-2-12-7-5-9-14(17-12)22-10-11-6-3-4-8-13(11)18-15(21)19-20-16/h3-9,20H,2,10,16H2,1H3,(H2,18,19,21)
InChIKeyVEMXUWSZMCQTBN-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.72
Rot. Bonds6

About 1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea

1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea (PubChem CID 144784630) has the molecular formula C15H19N5O2 and a molecular weight of 301.35 g/mol. Its IUPAC name is 1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea.

Molecular Properties

Compound Name1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea
PubChem CID144784630
Molecular FormulaC15H19N5O2
Molecular Weight301.35 g/mol
Exact Mass301.15
IUPAC Name1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea
SMILESCCc1cccc(OCc2ccccc2NC(=O)NNN)n1
InChIInChI=1S/C15H19N5O2/c1-2-12-7-5-9-14(17-12)22-10-11-6-3-4-8-13(11)18-15(21)19-20-16/h3-9,20H,2,10,16H2,1H3,(H2,18,19,21)
InChIKeyVEMXUWSZMCQTBN-UHFFFAOYSA-N
XLogP1.72
TPSA101.30 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.72
H-Bond Donors ≤ 54
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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Related Compounds

2-[(6-ethyl-2-pyridinyl)oxymethyl]-N,3-dimethylaniline;formohydrazide
CID 144784105
2-ethoxy-6-ethylpyridine
CID 58662042
1-[2-(methoxymethyl)phenyl]-3-methylurea
CID 115582115
1-amino-3-[2-[(6-chloro-2-pyridinyl)oxymethyl]-3-methylphenyl]urea
CID 144783811
[6-[(2-bromophenyl)methoxy]-2-pyridinyl]methanamine
CID 82828361
4-(aminomethyl)-N-(2-ethylphenyl)benzamide
CID 16782121
1-[2-(phenoxymethyl)phenyl]-3-propylurea
CID 60545912
[2-(2-ethylanilino)-2-oxoethyl] 3-hydroxybenzoate
CID 7483736
methyl 2-[2-[(6-bromo-2-pyridinyl)oxymethyl]phenyl]acetate
CID 19366333
2-ethyl-6-phenoxypyridine
CID 19828151
2-ethyl-6-methoxypyridine;formic acid
CID 175480647
1-[(2,3-dimethylphenoxy)methyl]-3-(2-ethylphenyl)urea
CID 108878458

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea?
The IUPAC name of 1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea (CID 144784630) is 1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea.
What is the SMILES notation for 1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea?
The canonical SMILES for 1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea is CCc1cccc(OCc2ccccc2NC(=O)NNN)n1.
What is the InChIKey of 1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea?
The InChIKey is VEMXUWSZMCQTBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2/c1-2-12-7-5-9-14(17-12)22-10-11-6-3-4-8-13(11)18-15(21)19-20-16/h3-9,20H,2,10,16H2,1H3,(H2,18,19,21).
What are the key properties of 1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea?
1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea has a molecular weight of 301.35 g/mol, XLogP of 1.72, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(6-ethyl-2-pyridinyl)oxymethyl]phenyl]-3-hydrazinylurea is sourced from PubChem (CID 144784630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).