6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine

C9H15N5O — CID 80907012

IUPAC6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine
SMILESNNc1cc(NC2CCOCC2)ncn1
InChIInChI=1S/C9H15N5O/c10-14-9-5-8(11-6-12-9)13-7-1-3-15-4-2-7/h5-7H,1-4,10H2,(H2,11,12,13,14)
InChIKeyHLMQGTHSCRPBQF-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.35
Rot. Bonds3

About 6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine

6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine (PubChem CID 80907012) has the molecular formula C9H15N5O and a molecular weight of 209.25 g/mol. Its IUPAC name is 6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine
PubChem CID80907012
Molecular FormulaC9H15N5O
Molecular Weight209.25 g/mol
Exact Mass209.13
IUPAC Name6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine
SMILESNNc1cc(NC2CCOCC2)ncn1
InChIInChI=1S/C9H15N5O/c10-14-9-5-8(11-6-12-9)13-7-1-3-15-4-2-7/h5-7H,1-4,10H2,(H2,11,12,13,14)
InChIKeyHLMQGTHSCRPBQF-UHFFFAOYSA-N
XLogP0.35
TPSA85.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.35
H-Bond Donors ≤ 53
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

6-N-(oxan-4-yl)-4-N-propan-2-ylpyrimidine-4,6-diamine
CID 115265760
N-(4-ethylcyclohexyl)-6-hydrazinylpyrimidin-4-amine
CID 80897461
[6-(oxan-4-yloxy)pyrimidin-4-yl]hydrazine
CID 80920018
1-[[6-(oxan-4-ylamino)pyrimidin-4-yl]amino]propan-2-one
CID 115265033
6-N-cyclohexyl-4-N-cyclopropylpyrimidine-4,6-diamine
CID 112854680
N-(1,1-dioxothiolan-3-yl)-6-hydrazinylpyrimidin-4-amine
CID 80932975
6-hydrazinyl-N-(2-oxabicyclo[4.2.0]octan-7-yl)pyrimidin-4-amine
CID 139330257
6-tert-butyl-N-[(3S)-oxolan-3-yl]pyrimidin-4-amine
CID 126724583
6-ethoxy-N-(oxolan-3-yl)pyrimidin-4-amine
CID 80713528
4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 115265146
6-hydrazinyl-N-(oxolan-3-yl)-2-propan-2-ylpyrimidin-4-amine
CID 80968703
2-ethyl-6-hydrazinyl-N-(oxolan-3-yl)pyrimidin-4-amine
CID 80937015

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine (CID 80907012) is 6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine is NNc1cc(NC2CCOCC2)ncn1.
What is the InChIKey of 6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine?
The InChIKey is HLMQGTHSCRPBQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5O/c10-14-9-5-8(11-6-12-9)13-7-1-3-15-4-2-7/h5-7H,1-4,10H2,(H2,11,12,13,14).
What are the key properties of 6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine?
6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine has a molecular weight of 209.25 g/mol, XLogP of 0.35, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(oxan-4-yl)pyrimidin-4-amine is sourced from PubChem (CID 80907012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).