[2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine

C12H18N4O — CID 63741787

IUPAC[2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
SMILESNNc1nc(C2CCCOC2)nc2c1CCC2
InChIInChI=1S/C12H18N4O/c13-16-12-9-4-1-5-10(9)14-11(15-12)8-3-2-6-17-7-8/h8H,1-7,13H2,(H,14,15,16)
InChIKeyQEEUDTACAWAMMM-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.14
Rot. Bonds2

About [2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine

[2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine (PubChem CID 63741787) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is [2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
PubChem CID63741787
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name[2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
SMILESNNc1nc(C2CCCOC2)nc2c1CCC2
InChIInChI=1S/C12H18N4O/c13-16-12-9-4-1-5-10(9)14-11(15-12)8-3-2-6-17-7-8/h8H,1-7,13H2,(H,14,15,16)
InChIKeyQEEUDTACAWAMMM-UHFFFAOYSA-N
XLogP1.14
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.14
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-(2,2,2-trifluoroethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 62251599
[2-(3,3,3-trifluoropropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 79964167
[2-[2-(2,2-difluoroethoxy)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 103150512
[2-[2-(2,2-Difluoroethoxy)ethyl]-6-ethyl-5-methylpyrimidin-4-yl]hydrazine
CID 103150538
[2-(2,2,2-trifluoroethoxymethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 103476371
[2-[2-(2,2,2-trifluoroethoxy)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 113781178
[6-Ethyl-5-methyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyrimidin-4-yl]hydrazine
CID 113781181
[2-(2,2,3,3-tetrafluoropropoxymethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 113820027
[2-(3,3-difluorocyclopentyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]hydrazine
CID 114216463
(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)hydrazine
CID 7541211
2-[(2R)-1-methoxybutan-2-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 140567304
N-ethyl-2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 55065933

Frequently Asked Questions

What is the IUPAC name of [2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine (CID 63741787) is [2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine is NNc1nc(C2CCCOC2)nc2c1CCC2.
What is the InChIKey of [2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine?
The InChIKey is QEEUDTACAWAMMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c13-16-12-9-4-1-5-10(9)14-11(15-12)8-3-2-6-17-7-8/h8H,1-7,13H2,(H,14,15,16).
What are the key properties of [2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine?
[2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine has a molecular weight of 234.30 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 63741787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).