[2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine

C13H16N4S — CID 62250929

IUPAC[2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine
SMILESCc1ccc(-c2nc3c(c(NN)n2)CCCC3)s1
InChIInChI=1S/C13H16N4S/c1-8-6-7-11(18-8)13-15-10-5-3-2-4-9(10)12(16-13)17-14/h6-7H,2-5,14H2,1H3,(H,15,16,17)
InChIKeyRWRUXGYGHKGGQN-UHFFFAOYSA-N
MW260.37 g/mol
LogP2.68
Rot. Bonds2

About [2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine

[2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine (PubChem CID 62250929) has the molecular formula C13H16N4S and a molecular weight of 260.37 g/mol. Its IUPAC name is [2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine
PubChem CID62250929
Molecular FormulaC13H16N4S
Molecular Weight260.37 g/mol
Exact Mass260.11
IUPAC Name[2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine
SMILESCc1ccc(-c2nc3c(c(NN)n2)CCCC3)s1
InChIInChI=1S/C13H16N4S/c1-8-6-7-11(18-8)13-15-10-5-3-2-4-9(10)12(16-13)17-14/h6-7H,2-5,14H2,1H3,(H,15,16,17)
InChIKeyRWRUXGYGHKGGQN-UHFFFAOYSA-N
XLogP2.68
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.37
LogP ≤ 52.68
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

N-ethyl-2-(5-methylthiophen-2-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 63480179
[2-(2-methylphenyl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine
CID 62252758
2-(5-bromothiophen-2-yl)-N-methyl-5,6,7,8-tetrahydroquinazolin-4-amine
CID 62202786
[5,6-dimethyl-2-(5-methylthiophen-2-yl)pyrimidin-4-yl]hydrazine
CID 62252622
[2-(2,4-dimethylphenyl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine
CID 62251116
[2-(2-methylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 62250852
[2-(4-chlorothiophen-2-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 79427224
[2-(2,5-dimethylphenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine
CID 63482428
[2-(4-methyl-1,3-thiazol-2-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 104771595
[2-(4-fluoro-3-methylphenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine
CID 63481875
[2-(5-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 81312713
[2-(2-methylfuran-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 104790753

Frequently Asked Questions

What is the IUPAC name of [2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine?
The IUPAC name of [2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine (CID 62250929) is [2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine.
What is the SMILES notation for [2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine?
The canonical SMILES for [2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine is Cc1ccc(-c2nc3c(c(NN)n2)CCCC3)s1.
What is the InChIKey of [2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine?
The InChIKey is RWRUXGYGHKGGQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4S/c1-8-6-7-11(18-8)13-15-10-5-3-2-4-9(10)12(16-13)17-14/h6-7H,2-5,14H2,1H3,(H,15,16,17).
What are the key properties of [2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine?
[2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine has a molecular weight of 260.37 g/mol, XLogP of 2.68, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine is sourced from PubChem (CID 62250929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).