[2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine

C16H14BrN3O — CID 79262180

IUPAC[2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine
SMILESNNc1ccnc(COc2ccc3ccccc3c2Br)c1
InChIInChI=1S/C16H14BrN3O/c17-16-14-4-2-1-3-11(14)5-6-15(16)21-10-13-9-12(20-18)7-8-19-13/h1-9H,10,18H2,(H,19,20)
InChIKeyYTUZPEKJQZSASE-UHFFFAOYSA-N
MW344.21 g/mol
LogP3.86
Rot. Bonds4

About [2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine

[2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine (PubChem CID 79262180) has the molecular formula C16H14BrN3O and a molecular weight of 344.21 g/mol. Its IUPAC name is [2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine.

Molecular Properties

Compound Name[2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine
PubChem CID79262180
Molecular FormulaC16H14BrN3O
Molecular Weight344.21 g/mol
Exact Mass343.03
IUPAC Name[2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine
SMILESNNc1ccnc(COc2ccc3ccccc3c2Br)c1
InChIInChI=1S/C16H14BrN3O/c17-16-14-4-2-1-3-11(14)5-6-15(16)21-10-13-9-12(20-18)7-8-19-13/h1-9H,10,18H2,(H,19,20)
InChIKeyYTUZPEKJQZSASE-UHFFFAOYSA-N
XLogP3.86
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.21
LogP ≤ 53.86
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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Related Compounds

VU0405601
CID 1301094
2-[(1-bromo-2-naphthyl)oxy]-N-(2-pyridinylmethyl)acetamide
CID 1300205
2-[(1-bromo-2-naphthyl)oxy]-N-4-pyridinylacetamide
CID 1301702
[2-(1-Bromonaphthalen-2-yl)oxy-3-fluoro-4-pyridinyl]methanamine
CID 105391387
2-[(1-bromo-2-naphthyl)oxy]-N-(3-pyridinylmethyl)acetamide
CID 1300539
2-[(1-bromo-2-naphthyl)oxy]-N-(4-pyridinylmethyl)acetamide
CID 1300933
3-(2-Naphthyloxy)-4-pyridinamine
CID 15068898
5-Bromo-6-(1,6-dibromonaphthalen-2-yl)oxypyridin-3-amine
CID 20280488
2-(6-Bromo-naphthalen-2-yloxymethyl)-pyridine
CID 54942869
5-Bromo-6-piperidin-3-yloxyisoquinoline
CID 57647028
3-[1-[2-(1,6-Dibromonaphthalen-2-yl)oxyethyl]-5-ethoxypyrazol-3-yl]pyridine
CID 69834920
4-[1-[2-(1,6-Dibromonaphthalen-2-yl)oxyethyl]-5-ethoxypyrazol-3-yl]pyridine
CID 69835820

Frequently Asked Questions

What is the IUPAC name of [2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine?
The IUPAC name of [2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine (CID 79262180) is [2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine.
What is the SMILES notation for [2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine?
The canonical SMILES for [2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine is NNc1ccnc(COc2ccc3ccccc3c2Br)c1.
What is the InChIKey of [2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine?
The InChIKey is YTUZPEKJQZSASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14BrN3O/c17-16-14-4-2-1-3-11(14)5-6-15(16)21-10-13-9-12(20-18)7-8-19-13/h1-9H,10,18H2,(H,19,20).
What are the key properties of [2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine?
[2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine has a molecular weight of 344.21 g/mol, XLogP of 3.86, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(1-bromonaphthalen-2-yl)oxymethyl]-4-pyridinyl]hydrazine is sourced from PubChem (CID 79262180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).