3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine

C22H20N6O — CID 168922645

IUPAC3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine
SMILESCC1COCCN1c1nc(-c2ccnc(-c3ccccc3)n2)nc2cccnc12
InChIInChI=1S/C22H20N6O/c1-15-14-29-13-12-28(15)22-19-17(8-5-10-23-19)25-21(27-22)18-9-11-24-20(26-18)16-6-3-2-4-7-16/h2-11,15H,12-14H2,1H3
InChIKeyGNSKQCLYVBZFKS-UHFFFAOYSA-N
MW384.44 g/mol
LogP3.37
Rot. Bonds3

About 3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine

3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine (PubChem CID 168922645) has the molecular formula C22H20N6O and a molecular weight of 384.44 g/mol. Its IUPAC name is 3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine
PubChem CID168922645
Molecular FormulaC22H20N6O
Molecular Weight384.44 g/mol
Exact Mass384.17
IUPAC Name3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine
SMILESCC1COCCN1c1nc(-c2ccnc(-c3ccccc3)n2)nc2cccnc12
InChIInChI=1S/C22H20N6O/c1-15-14-29-13-12-28(15)22-19-17(8-5-10-23-19)25-21(27-22)18-9-11-24-20(26-18)16-6-3-2-4-7-16/h2-11,15H,12-14H2,1H3
InChIKeyGNSKQCLYVBZFKS-UHFFFAOYSA-N
XLogP3.37
TPSA76.92 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(2-iodopyrido[3,2-d]pyrimidin-4-yl)-3-methylmorpholine
CID 168922548
N-hydroxy-4-[4-[(3S)-3-methylmorpholin-4-yl]quinazolin-2-yl]benzamide
CID 164610201
ethane;4-[2-(2-piperidin-4-ylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine
CID 168922532
(3R)-4-[6-(2-fluoro-3-pyridinyl)-2-(1H-indol-4-yl)pyrido[3,2-d]pyrimidin-4-yl]-3-methylmorpholine
CID 175965732
3-(3-methylmorpholin-4-yl)-2-phenylquinoxaline-6-carboxylic acid
CID 50991206
5-[4-[(3S)-3-methylmorpholin-4-yl]thieno[3,2-d]pyrimidin-2-yl]pyrimidin-2-amine
CID 59829320
2-(3-methylmorpholin-4-yl)pyridine-3-carboxamide
CID 155353856
(3S)-3-(5-methyl-1,2,4-oxadiazol-3-yl)-4-(2-phenylpyrimidin-4-yl)morpholine
CID 97344130
4-[2-(6-piperidin-4-yl-2-pyridinyl)pyrido[3,2-d]pyrimidin-4-yl]morpholine
CID 168922642
(3R)-4-[4-(4-fluorophenyl)pyrimidin-2-yl]-3-methylmorpholine
CID 141135548
(3S)-3-methyl-4-[2-phenyl-6-(pyridin-2-ylsulfonylmethyl)pyrimidin-4-yl]morpholine
CID 141203775
(3R)-3-methyl-4-[7-pyridin-2-yl-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)thieno[3,2-d]pyrimidin-4-yl]morpholine
CID 175865159

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine?
The IUPAC name of 3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine (CID 168922645) is 3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine.
What is the SMILES notation for 3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine?
The canonical SMILES for 3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine is CC1COCCN1c1nc(-c2ccnc(-c3ccccc3)n2)nc2cccnc12.
What is the InChIKey of 3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine?
The InChIKey is GNSKQCLYVBZFKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N6O/c1-15-14-29-13-12-28(15)22-19-17(8-5-10-23-19)25-21(27-22)18-9-11-24-20(26-18)16-6-3-2-4-7-16/h2-11,15H,12-14H2,1H3.
What are the key properties of 3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine?
3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine has a molecular weight of 384.44 g/mol, XLogP of 3.37, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-[2-(2-phenylpyrimidin-4-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine is sourced from PubChem (CID 168922645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).