[(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine

C15H12Br2N2S — CID 107970229

IUPAC[(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine
SMILESNNC(c1cc(Br)sc1Br)c1cccc2ccccc12
InChIInChI=1S/C15H12Br2N2S/c16-13-8-12(15(17)20-13)14(19-18)11-7-3-5-9-4-1-2-6-10(9)11/h1-8,14,19H,18H2
InChIKeyCWYURPSFYFGWTB-UHFFFAOYSA-N
MW412.15 g/mol
LogP4.98
Rot. Bonds3

About [(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine

[(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine (PubChem CID 107970229) has the molecular formula C15H12Br2N2S and a molecular weight of 412.15 g/mol. Its IUPAC name is [(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine
PubChem CID107970229
Molecular FormulaC15H12Br2N2S
Molecular Weight412.15 g/mol
Exact Mass409.91
IUPAC Name[(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine
SMILESNNC(c1cc(Br)sc1Br)c1cccc2ccccc12
InChIInChI=1S/C15H12Br2N2S/c16-13-8-12(15(17)20-13)14(19-18)11-7-3-5-9-4-1-2-6-10(9)11/h1-8,14,19H,18H2
InChIKeyCWYURPSFYFGWTB-UHFFFAOYSA-N
XLogP4.98
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.15
LogP ≤ 54.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

2,5-dibromo-3-[bromo(naphthalen-1-yl)methyl]thiophene
CID 63443034
[(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine
CID 107970220
[(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 107970496
[(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine
CID 107970581
[(2,5-dibromothiophen-3-yl)-(2,6-difluorophenyl)methyl]hydrazine
CID 107970307
[(5-bromo-2-methylphenyl)-naphthalen-1-ylmethyl]hydrazine
CID 105301219
[(4-bromophenyl)-naphthalen-1-ylmethyl]hydrazine
CID 105192517
2,5-dibromo-3-(1-bromo-2-naphthalen-1-ylethyl)thiophene
CID 107965769
1-(2,5-dibromothiophen-3-yl)-N-methyl-1-(2-methylnaphthalen-1-yl)methanamine
CID 107961216
[(2,5-dibromothiophen-3-yl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 107970684
[(2,5-dibromothiophen-3-yl)-(2,3-difluoro-4-methylphenyl)methyl]hydrazine
CID 107970741
1-(1-benzothiophen-7-yl)-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine
CID 107968843

Frequently Asked Questions

What is the IUPAC name of [(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine?
The IUPAC name of [(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine (CID 107970229) is [(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine.
What is the SMILES notation for [(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine?
The canonical SMILES for [(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine is NNC(c1cc(Br)sc1Br)c1cccc2ccccc12.
What is the InChIKey of [(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine?
The InChIKey is CWYURPSFYFGWTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Br2N2S/c16-13-8-12(15(17)20-13)14(19-18)11-7-3-5-9-4-1-2-6-10(9)11/h1-8,14,19H,18H2.
What are the key properties of [(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine?
[(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine has a molecular weight of 412.15 g/mol, XLogP of 4.98, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine is sourced from PubChem (CID 107970229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).