[2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine

C14H13FN4S — CID 81278265

IUPAC[2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCc1cc2c(NN)nc(-c3ccc(F)cc3C)nc2s1
InChIInChI=1S/C14H13FN4S/c1-7-5-9(15)3-4-10(7)12-17-13(19-16)11-6-8(2)20-14(11)18-12/h3-6H,16H2,1-2H3,(H,17,18,19)
InChIKeyATVOZQPMGNBYJU-UHFFFAOYSA-N
MW288.35 g/mol
LogP3.40
Rot. Bonds2

About [2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine

[2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine (PubChem CID 81278265) has the molecular formula C14H13FN4S and a molecular weight of 288.35 g/mol. Its IUPAC name is [2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine
PubChem CID81278265
Molecular FormulaC14H13FN4S
Molecular Weight288.35 g/mol
Exact Mass288.08
IUPAC Name[2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCc1cc2c(NN)nc(-c3ccc(F)cc3C)nc2s1
InChIInChI=1S/C14H13FN4S/c1-7-5-9(15)3-4-10(7)12-17-13(19-16)11-6-8(2)20-14(11)18-12/h3-6H,16H2,1-2H3,(H,17,18,19)
InChIKeyATVOZQPMGNBYJU-UHFFFAOYSA-N
XLogP3.40
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 53.40
H-Bond Donors ≤ 52
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

2,4-Diamino-6-benzyl-5-methylthieno[2,3-d]pyrimidine
CID 457382
2-Phenylthieno(2,3-d)pyrimidin-4-amine
CID 62188326
2-Phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine
CID 337817
5-Methyl-6-phenyl-thieno[2,3-d]pyrimidine-2,4-diamine
CID 457380
(2,5-Dithiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)hydrazine
CID 24898259
3-(4-Amino-6-benzyl-thieno[2,3-d]pyrimidin-2-yl)-benzonitrile
CID 45275056
6-Benzyl-2-phenyl-thieno[2,3-d]pyrimidin-4-ylamine
CID 45275058
3-[4-Amino-6-(1-phenyl-vinyl)-thieno[2,3-d]pyrimidin-2-yl]-benzonitrile
CID 45275060
(+/-)-3-[4-Amino-6-(1-phenyl-ethyl)-thieno [2,3-d]pyrimidin-2-yl]-benzonitrile
CID 45275170
6-Benzyl-2-(3-trifluoromethyl-phenyl)-thieno[2,3-d]pyrimidin-4-ylamine
CID 45275171
6-Benzyl-2-(3-fluoro-phenyl)-thieno[2,3-d]pyrimidin-4-ylamine
CID 45275173
1-[[6-(4-Fluorophenyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]amino]-3-methylpyrrole-2,5-dione
CID 118464648

Frequently Asked Questions

What is the IUPAC name of [2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine (CID 81278265) is [2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine is Cc1cc2c(NN)nc(-c3ccc(F)cc3C)nc2s1.
What is the InChIKey of [2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine?
The InChIKey is ATVOZQPMGNBYJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN4S/c1-7-5-9(15)3-4-10(7)12-17-13(19-16)11-6-8(2)20-14(11)18-12/h3-6H,16H2,1-2H3,(H,17,18,19).
What are the key properties of [2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine?
[2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine has a molecular weight of 288.35 g/mol, XLogP of 3.40, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluoro-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 81278265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).