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

C12H18N4O — CID 62385407

IUPAC[2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
SMILESNNc1nc(C2CCOCC2)nc2c1CCC2
InChIInChI=1S/C12H18N4O/c13-16-12-9-2-1-3-10(9)14-11(15-12)8-4-6-17-7-5-8/h8H,1-7,13H2,(H,14,15,16)
InChIKeyWQGNSEADPVDRMO-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.14
Rot. Bonds2

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

[2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine (PubChem CID 62385407) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is [2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
PubChem CID62385407
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name[2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
SMILESNNc1nc(C2CCOCC2)nc2c1CCC2
InChIInChI=1S/C12H18N4O/c13-16-12-9-2-1-3-10(9)14-11(15-12)8-4-6-17-7-5-8/h8H,1-7,13H2,(H,14,15,16)
InChIKeyWQGNSEADPVDRMO-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-(oxolan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 62312919
[2-(oxan-4-yl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]hydrazine
CID 106473502
[2-(oxan-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 63741787
[2-(oxan-3-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine
CID 63740201
4-chloro-2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 62386841
[2-(5-methyloxolan-2-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 82839401
4-chloro-2-(oxan-4-yl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
CID 106470680
4-(2-cyclopropyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)morpholine
CID 53192899
[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 64986048
[2-(oxan-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83201096
[2-(1,4-diazabicyclo[2.2.2]octan-2-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine
CID 79961342
N-methyl-2-(thiolan-2-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 80638067

Frequently Asked Questions

What is the IUPAC name of [2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine (CID 62385407) is [2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine is NNc1nc(C2CCOCC2)nc2c1CCC2.
What is the InChIKey of [2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine?
The InChIKey is WQGNSEADPVDRMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c13-16-12-9-2-1-3-10(9)14-11(15-12)8-4-6-17-7-5-8/h8H,1-7,13H2,(H,14,15,16).
What are the key properties of [2-(oxan-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine?
[2-(oxan-4-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-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62385407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).