[2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine

C14H19N5O — CID 63351656

IUPAC[2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine
SMILESCc1noc(C)c1-c1nc2c(c(NN)n1)CCCCC2
InChIInChI=1S/C14H19N5O/c1-8-12(9(2)20-19-8)14-16-11-7-5-3-4-6-10(11)13(17-14)18-15/h3-7,15H2,1-2H3,(H,16,17,18)
InChIKeyUHSKOMDUMPEOMO-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.30
Rot. Bonds2

About [2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine

[2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine (PubChem CID 63351656) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is [2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine
PubChem CID63351656
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name[2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine
SMILESCc1noc(C)c1-c1nc2c(c(NN)n1)CCCCC2
InChIInChI=1S/C14H19N5O/c1-8-12(9(2)20-19-8)14-16-11-7-5-3-4-6-10(11)13(17-14)18-15/h3-7,15H2,1-2H3,(H,16,17,18)
InChIKeyUHSKOMDUMPEOMO-UHFFFAOYSA-N
XLogP2.30
TPSA89.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.30
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-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 62201733
[2-(3,5-dimethyl-1,2-oxazol-4-yl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine
CID 55210530
[2-(2-methylphenyl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine
CID 62252758
[2-(2-methylfuran-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 104790753
[2-(2,5-dimethylphenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine
CID 63482428
[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-(4-fluoro-3-methylphenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine
CID 63481875
[2-(2,4-dimethylphenyl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine
CID 62251116
[2-(4-methyl-1,3-thiazol-2-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 104771595
[2-(2-methylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 62250852
[2-(5-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 81312713

Frequently Asked Questions

What is the IUPAC name of [2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine (CID 63351656) is [2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine is Cc1noc(C)c1-c1nc2c(c(NN)n1)CCCCC2.
What is the InChIKey of [2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine?
The InChIKey is UHSKOMDUMPEOMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-8-12(9(2)20-19-8)14-16-11-7-5-3-4-6-10(11)13(17-14)18-15/h3-7,15H2,1-2H3,(H,16,17,18).
What are the key properties of [2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine?
[2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine has a molecular weight of 273.34 g/mol, XLogP of 2.30, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 63351656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).