[5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine

C11H18ClN5O — CID 80896237

IUPAC[5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine
SMILESCCC1COC(C)CN1c1nc(NN)ncc1Cl
InChIInChI=1S/C11H18ClN5O/c1-3-8-6-18-7(2)5-17(8)10-9(12)4-14-11(15-10)16-13/h4,7-8H,3,5-6,13H2,1-2H3,(H,14,15,16)
InChIKeyRMPYGOVQBDMBGQ-UHFFFAOYSA-N
MW271.75 g/mol
LogP1.42
Rot. Bonds3

About [5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine

[5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine (PubChem CID 80896237) has the molecular formula C11H18ClN5O and a molecular weight of 271.75 g/mol. Its IUPAC name is [5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine
PubChem CID80896237
Molecular FormulaC11H18ClN5O
Molecular Weight271.75 g/mol
Exact Mass271.12
IUPAC Name[5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine
SMILESCCC1COC(C)CN1c1nc(NN)ncc1Cl
InChIInChI=1S/C11H18ClN5O/c1-3-8-6-18-7(2)5-17(8)10-9(12)4-14-11(15-10)16-13/h4,7-8H,3,5-6,13H2,1-2H3,(H,14,15,16)
InChIKeyRMPYGOVQBDMBGQ-UHFFFAOYSA-N
XLogP1.42
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.75
LogP ≤ 51.42
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-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine?
The IUPAC name of [5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine (CID 80896237) is [5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine.
What is the SMILES notation for [5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine?
The canonical SMILES for [5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine is CCC1COC(C)CN1c1nc(NN)ncc1Cl.
What is the InChIKey of [5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine?
The InChIKey is RMPYGOVQBDMBGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18ClN5O/c1-3-8-6-18-7(2)5-17(8)10-9(12)4-14-11(15-10)16-13/h4,7-8H,3,5-6,13H2,1-2H3,(H,14,15,16).
What are the key properties of [5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine?
[5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine has a molecular weight of 271.75 g/mol, XLogP of 1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-yl]hydrazine is sourced from PubChem (CID 80896237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).