2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol

C18H18N4O2 — CID 137261999

IUPAC2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol
SMILESCc1cnc2c(N3CCOCC3)nc(-c3ccccc3O)nc2c1
InChIInChI=1S/C18H18N4O2/c1-12-10-14-16(19-11-12)18(22-6-8-24-9-7-22)21-17(20-14)13-4-2-3-5-15(13)23/h2-5,10-11,23H,6-9H2,1H3
InChIKeyNQEDCZUGRCKZPW-UHFFFAOYSA-N
MW322.37 g/mol
LogP2.54
Rot. Bonds2

About 2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol

2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol (PubChem CID 137261999) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is 2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol.

Molecular Properties

Compound Name2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol
PubChem CID137261999
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC Name2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol
SMILESCc1cnc2c(N3CCOCC3)nc(-c3ccccc3O)nc2c1
InChIInChI=1S/C18H18N4O2/c1-12-10-14-16(19-11-12)18(22-6-8-24-9-7-22)21-17(20-14)13-4-2-3-5-15(13)23/h2-5,10-11,23H,6-9H2,1H3
InChIKeyNQEDCZUGRCKZPW-UHFFFAOYSA-N
XLogP2.54
TPSA71.37 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol?
The IUPAC name of 2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol (CID 137261999) is 2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol.
What is the SMILES notation for 2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol?
The canonical SMILES for 2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol is Cc1cnc2c(N3CCOCC3)nc(-c3ccccc3O)nc2c1.
What is the InChIKey of 2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol?
The InChIKey is NQEDCZUGRCKZPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-12-10-14-16(19-11-12)18(22-6-8-24-9-7-22)21-17(20-14)13-4-2-3-5-15(13)23/h2-5,10-11,23H,6-9H2,1H3.
What are the key properties of 2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol?
2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol has a molecular weight of 322.37 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)phenol is sourced from PubChem (CID 137261999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).