[5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine

C10H16FN5O — CID 66936366

IUPAC[5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine
SMILESCc1nc(NN)c(F)c(N2CCOC[C@@H]2C)n1
InChIInChI=1S/C10H16FN5O/c1-6-5-17-4-3-16(6)10-8(11)9(15-12)13-7(2)14-10/h6H,3-5,12H2,1-2H3,(H,13,14,15)/t6-/m0/s1
InChIKeyKENPJBJWTFGQJX-LURJTMIESA-N
MW241.27 g/mol
LogP0.43
Rot. Bonds2

About [5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine

[5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine (PubChem CID 66936366) has the molecular formula C10H16FN5O and a molecular weight of 241.27 g/mol. Its IUPAC name is [5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine
PubChem CID66936366
Molecular FormulaC10H16FN5O
Molecular Weight241.27 g/mol
Exact Mass241.13
IUPAC Name[5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine
SMILESCc1nc(NN)c(F)c(N2CCOC[C@@H]2C)n1
InChIInChI=1S/C10H16FN5O/c1-6-5-17-4-3-16(6)10-8(11)9(15-12)13-7(2)14-10/h6H,3-5,12H2,1-2H3,(H,13,14,15)/t6-/m0/s1
InChIKeyKENPJBJWTFGQJX-LURJTMIESA-N
XLogP0.43
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.27
LogP ≤ 50.43
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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Frequently Asked Questions

What is the IUPAC name of [5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine?
The IUPAC name of [5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine (CID 66936366) is [5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine is Cc1nc(NN)c(F)c(N2CCOC[C@@H]2C)n1.
What is the InChIKey of [5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine?
The InChIKey is KENPJBJWTFGQJX-LURJTMIESA-N. The full InChI is InChI=1S/C10H16FN5O/c1-6-5-17-4-3-16(6)10-8(11)9(15-12)13-7(2)14-10/h6H,3-5,12H2,1-2H3,(H,13,14,15)/t6-/m0/s1.
What are the key properties of [5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine?
[5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine has a molecular weight of 241.27 g/mol, XLogP of 0.43, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-2-methyl-6-[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 66936366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).