[2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol

C19H22N4O2 — CID 133365164

IUPAC[2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol
SMILESCn1cc(C2(C)CN(c3nc4ccccc4cc3CO)CCO2)cn1
InChIInChI=1S/C19H22N4O2/c1-19(16-10-20-22(2)11-16)13-23(7-8-25-19)18-15(12-24)9-14-5-3-4-6-17(14)21-18/h3-6,9-11,24H,7-8,12-13H2,1-2H3
InChIKeyULEFSAJDQYOXCE-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.21
Rot. Bonds3

About [2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol

[2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol (PubChem CID 133365164) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is [2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol.

Molecular Properties

Compound Name[2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol
PubChem CID133365164
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC Name[2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol
SMILESCn1cc(C2(C)CN(c3nc4ccccc4cc3CO)CCO2)cn1
InChIInChI=1S/C19H22N4O2/c1-19(16-10-20-22(2)11-16)13-23(7-8-25-19)18-15(12-24)9-14-5-3-4-6-17(14)21-18/h3-6,9-11,24H,7-8,12-13H2,1-2H3
InChIKeyULEFSAJDQYOXCE-UHFFFAOYSA-N
XLogP2.21
TPSA63.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol?
The IUPAC name of [2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol (CID 133365164) is [2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol.
What is the SMILES notation for [2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol?
The canonical SMILES for [2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol is Cn1cc(C2(C)CN(c3nc4ccccc4cc3CO)CCO2)cn1.
What is the InChIKey of [2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol?
The InChIKey is ULEFSAJDQYOXCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-19(16-10-20-22(2)11-16)13-23(7-8-25-19)18-15(12-24)9-14-5-3-4-6-17(14)21-18/h3-6,9-11,24H,7-8,12-13H2,1-2H3.
What are the key properties of [2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol?
[2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol has a molecular weight of 338.41 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]quinolin-3-yl]methanol is sourced from PubChem (CID 133365164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).