[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine

C13H17N5S — CID 55120817

IUPAC[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine
SMILESCc1csc(Cc2nc3c(c(NN)n2)CCCC3)n1
InChIInChI=1S/C13H17N5S/c1-8-7-19-12(15-8)6-11-16-10-5-3-2-4-9(10)13(17-11)18-14/h7H,2-6,14H2,1H3,(H,16,17,18)
InChIKeyASYJMZAFGYJAJI-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.00
Rot. Bonds3

About [2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine

[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine (PubChem CID 55120817) has the molecular formula C13H17N5S and a molecular weight of 275.38 g/mol. Its IUPAC name is [2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine
PubChem CID55120817
Molecular FormulaC13H17N5S
Molecular Weight275.38 g/mol
Exact Mass275.12
IUPAC Name[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine
SMILESCc1csc(Cc2nc3c(c(NN)n2)CCCC3)n1
InChIInChI=1S/C13H17N5S/c1-8-7-19-12(15-8)6-11-16-10-5-3-2-4-9(10)13(17-11)18-14/h7H,2-6,14H2,1H3,(H,16,17,18)
InChIKeyASYJMZAFGYJAJI-UHFFFAOYSA-N
XLogP2.00
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-methyl-1,3-thiazol-2-yl)methyl]-N-propyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 62795351
[2-(4-methyl-1,3-thiazol-2-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 104771595
[2-[(3,5-dimethylphenyl)methyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 62596851
[2-(thiophen-2-ylmethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine
CID 63351692
[2-[(2-fluorophenyl)methyl]-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine
CID 63351433
N,N-diethyl-2-(4-hydrazinyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-2-yl)ethanamine
CID 63351901
[2-[(2,4-dichlorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 62252161
[2-(tert-butylsulfanylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 65137980
[2-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine
CID 62250929
(2-fluoro-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl)hydrazine
CID 142163841
[2-[(3-chloro-2-fluorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 82805386
5-bromo-N-ethyl-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-6-propylpyrimidin-4-amine
CID 66307752

Frequently Asked Questions

What is the IUPAC name of [2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine?
The IUPAC name of [2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine (CID 55120817) is [2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine.
What is the SMILES notation for [2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine?
The canonical SMILES for [2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine is Cc1csc(Cc2nc3c(c(NN)n2)CCCC3)n1.
What is the InChIKey of [2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine?
The InChIKey is ASYJMZAFGYJAJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5S/c1-8-7-19-12(15-8)6-11-16-10-5-3-2-4-9(10)13(17-11)18-14/h7H,2-6,14H2,1H3,(H,16,17,18).
What are the key properties of [2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine?
[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine has a molecular weight of 275.38 g/mol, XLogP of 2.00, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine is sourced from PubChem (CID 55120817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).