1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine

C24H28N6O2 — CID 89163648

IUPAC1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine
SMILESC=C(NNc1cccc(C)c1)c1cc(N2CCOCC2)nc(OCCc2ccccn2)n1
InChIInChI=1S/C24H28N6O2/c1-18-6-5-8-21(16-18)29-28-19(2)22-17-23(30-11-14-31-15-12-30)27-24(26-22)32-13-9-20-7-3-4-10-25-20/h3-8,10,16-17,28-29H,2,9,11-15H2,1H3
InChIKeyCWNVNBMOVIYUJJ-UHFFFAOYSA-N
MW432.53 g/mol
LogP3.23
Rot. Bonds9

About 1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine

1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine (PubChem CID 89163648) has the molecular formula C24H28N6O2 and a molecular weight of 432.53 g/mol. Its IUPAC name is 1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine.

Molecular Properties

Compound Name1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine
PubChem CID89163648
Molecular FormulaC24H28N6O2
Molecular Weight432.53 g/mol
Exact Mass432.23
IUPAC Name1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine
SMILESC=C(NNc1cccc(C)c1)c1cc(N2CCOCC2)nc(OCCc2ccccn2)n1
InChIInChI=1S/C24H28N6O2/c1-18-6-5-8-21(16-18)29-28-19(2)22-17-23(30-11-14-31-15-12-30)27-24(26-22)32-13-9-20-7-3-4-10-25-20/h3-8,10,16-17,28-29H,2,9,11-15H2,1H3
InChIKeyCWNVNBMOVIYUJJ-UHFFFAOYSA-N
XLogP3.23
TPSA84.43 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.53
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine?
The IUPAC name of 1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine (CID 89163648) is 1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine.
What is the SMILES notation for 1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine?
The canonical SMILES for 1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine is C=C(NNc1cccc(C)c1)c1cc(N2CCOCC2)nc(OCCc2ccccn2)n1.
What is the InChIKey of 1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine?
The InChIKey is CWNVNBMOVIYUJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N6O2/c1-18-6-5-8-21(16-18)29-28-19(2)22-17-23(30-11-14-31-15-12-30)27-24(26-22)32-13-9-20-7-3-4-10-25-20/h3-8,10,16-17,28-29H,2,9,11-15H2,1H3.
What are the key properties of 1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine?
1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine has a molecular weight of 432.53 g/mol, XLogP of 3.23, 9 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylphenyl)-2-[1-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]ethenyl]hydrazine is sourced from PubChem (CID 89163648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).