[6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine

C10H16F2N4O — CID 82010198

IUPAC[6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1c(NN)nc(C(C)C)nc1OCC(F)F
InChIInChI=1S/C10H16F2N4O/c1-5(2)8-14-9(16-13)6(3)10(15-8)17-4-7(11)12/h5,7H,4,13H2,1-3H3,(H,14,15,16)
InChIKeyCSJFWWILMOXVPT-UHFFFAOYSA-N
MW246.26 g/mol
LogP1.84
Rot. Bonds5

About [6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine

[6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 82010198) has the molecular formula C10H16F2N4O and a molecular weight of 246.26 g/mol. Its IUPAC name is [6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID82010198
Molecular FormulaC10H16F2N4O
Molecular Weight246.26 g/mol
Exact Mass246.13
IUPAC Name[6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1c(NN)nc(C(C)C)nc1OCC(F)F
InChIInChI=1S/C10H16F2N4O/c1-5(2)8-14-9(16-13)6(3)10(15-8)17-4-7(11)12/h5,7H,4,13H2,1-3H3,(H,14,15,16)
InChIKeyCSJFWWILMOXVPT-UHFFFAOYSA-N
XLogP1.84
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.26
LogP ≤ 51.84
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

6-Methoxy-2-methyl-5-(trifluoromethyl)pyrimidin-4-amine
CID 13379306
4-Hydrazino-6-methoxy-2-methyl-5-(trifluoromethyl)pyrimidine
CID 18544800
2,5-Dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine
CID 80858915
N,2,5-trimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine
CID 80859006
2,5-dimethyl-N-propyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine
CID 80859358
N-ethyl-2,5-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine
CID 80859359
N-ethyl-2,5-dimethyl-6-(2,2,3,3-tetrafluoropropoxy)pyrimidin-4-amine
CID 80867714
2,5-Dimethyl-6-(2,2,3,3-tetrafluoropropoxy)pyrimidin-4-amine
CID 80868555
N,2,5-trimethyl-6-(2,2,3,3-tetrafluoropropoxy)pyrimidin-4-amine
CID 80868716
2,5-dimethyl-N-propyl-6-(2,2,3,3-tetrafluoropropoxy)pyrimidin-4-amine
CID 80868961
2,5-dimethyl-6-(2,2,3,3,3-pentafluoropropoxy)-N-propylpyrimidin-4-amine
CID 80871132
N-ethyl-2,5-dimethyl-6-(2,2,3,3,3-pentafluoropropoxy)pyrimidin-4-amine
CID 80877240

Frequently Asked Questions

What is the IUPAC name of [6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine (CID 82010198) is [6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine is Cc1c(NN)nc(C(C)C)nc1OCC(F)F.
What is the InChIKey of [6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is CSJFWWILMOXVPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F2N4O/c1-5(2)8-14-9(16-13)6(3)10(15-8)17-4-7(11)12/h5,7H,4,13H2,1-3H3,(H,14,15,16).
What are the key properties of [6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine?
[6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 246.26 g/mol, XLogP of 1.84, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,2-difluoroethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 82010198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).