4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine

C16H20N6O — CID 71138631

IUPAC4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine
SMILESCCn1cc(-c2c(C)nc3c(N4CCOCC4)cncn23)cn1
InChIInChI=1S/C16H20N6O/c1-3-21-10-13(8-18-21)15-12(2)19-16-14(9-17-11-22(15)16)20-4-6-23-7-5-20/h8-11H,3-7H2,1-2H3
InChIKeyYNCCWQXJJIGZOI-UHFFFAOYSA-N
MW312.38 g/mol
LogP1.76
Rot. Bonds3

About 4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine

4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine (PubChem CID 71138631) has the molecular formula C16H20N6O and a molecular weight of 312.38 g/mol. Its IUPAC name is 4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine.

Molecular Properties

Compound Name4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine
PubChem CID71138631
Molecular FormulaC16H20N6O
Molecular Weight312.38 g/mol
Exact Mass312.17
IUPAC Name4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine
SMILESCCn1cc(-c2c(C)nc3c(N4CCOCC4)cncn23)cn1
InChIInChI=1S/C16H20N6O/c1-3-21-10-13(8-18-21)15-12(2)19-16-14(9-17-11-22(15)16)20-4-6-23-7-5-20/h8-11H,3-7H2,1-2H3
InChIKeyYNCCWQXJJIGZOI-UHFFFAOYSA-N
XLogP1.76
TPSA60.48 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.38
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine?
The IUPAC name of 4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine (CID 71138631) is 4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine.
What is the SMILES notation for 4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine?
The canonical SMILES for 4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine is CCn1cc(-c2c(C)nc3c(N4CCOCC4)cncn23)cn1.
What is the InChIKey of 4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine?
The InChIKey is YNCCWQXJJIGZOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6O/c1-3-21-10-13(8-18-21)15-12(2)19-16-14(9-17-11-22(15)16)20-4-6-23-7-5-20/h8-11H,3-7H2,1-2H3.
What are the key properties of 4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine?
4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine has a molecular weight of 312.38 g/mol, XLogP of 1.76, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(1-ethylpyrazol-4-yl)-2-methylimidazo[1,2-c]pyrimidin-8-yl]morpholine is sourced from PubChem (CID 71138631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).