8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one

C19H19N5O2 — CID 3234043

IUPAC8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one
SMILESO=c1c(-c2ccccc2)nc2cnc(N3CCOCC3)nc2n1C1CC1
InChIInChI=1S/C19H19N5O2/c25-18-16(13-4-2-1-3-5-13)21-15-12-20-19(23-8-10-26-11-9-23)22-17(15)24(18)14-6-7-14/h1-5,12,14H,6-11H2
InChIKeyPUSWXRFYDVIWLZ-UHFFFAOYSA-N
MW349.39 g/mol
LogP2.03
Rot. Bonds3

About 8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one

8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one (PubChem CID 3234043) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is 8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one.

Molecular Properties

Compound Name8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one
PubChem CID3234043
Molecular FormulaC19H19N5O2
Molecular Weight349.39 g/mol
Exact Mass349.15
IUPAC Name8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one
SMILESO=c1c(-c2ccccc2)nc2cnc(N3CCOCC3)nc2n1C1CC1
InChIInChI=1S/C19H19N5O2/c25-18-16(13-4-2-1-3-5-13)21-15-12-20-19(23-8-10-26-11-9-23)22-17(15)24(18)14-6-7-14/h1-5,12,14H,6-11H2
InChIKeyPUSWXRFYDVIWLZ-UHFFFAOYSA-N
XLogP2.03
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

8-cyclopropyl-6-phenyl-2-piperazin-1-ylpteridin-7-one
CID 3232697
8-methyl-2-(4-methylpiperazin-1-yl)-6-phenylpteridin-7-one
CID 3234627
6-(4-fluorophenyl)-2-morpholin-4-yl-8-[[(2R)-oxolan-2-yl]methyl]pteridin-7-one
CID 3234605
6-(4-methoxyphenyl)-2-morpholin-4-yl-8-(thiophen-2-ylmethyl)pteridin-7-one
CID 3234928
6,8-dimethyl-2-morpholin-4-ylpteridin-7-one
CID 3234245
3-[6-(3,5-difluorophenyl)-2-morpholin-4-yl-7-oxopteridin-8-yl]propanenitrile
CID 3235457
2-(benzimidazol-1-yl)-9-(oxan-4-yl)-8-phenylpurine
CID 59705009
8-(4-methoxyphenyl)-2-morpholin-4-yl-6-thiophen-2-ylpteridin-7-one
CID 3233814
6-methyl-2-morpholin-4-yl-8-[[(2R)-oxolan-2-yl]methyl]pteridin-7-one
CID 3233955
4-pyrido[3,2-d]pyrimidin-2-ylmorpholine
CID 67130702
6-(3,5-difluorophenyl)-8-phenyl-2-piperazin-1-ylpteridin-7-one
CID 3233487
4-[5-(3-phenyl-2,7,12-triazatricyclo[6.4.0.02,6]dodeca-1(8),6,9,11-tetraen-11-yl)pyrimidin-2-yl]morpholine
CID 122621739

Frequently Asked Questions

What is the IUPAC name of 8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one?
The IUPAC name of 8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one (CID 3234043) is 8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one.
What is the SMILES notation for 8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one?
The canonical SMILES for 8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one is O=c1c(-c2ccccc2)nc2cnc(N3CCOCC3)nc2n1C1CC1.
What is the InChIKey of 8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one?
The InChIKey is PUSWXRFYDVIWLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2/c25-18-16(13-4-2-1-3-5-13)21-15-12-20-19(23-8-10-26-11-9-23)22-17(15)24(18)14-6-7-14/h1-5,12,14H,6-11H2.
What are the key properties of 8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one?
8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one has a molecular weight of 349.39 g/mol, XLogP of 2.03, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one is sourced from PubChem (CID 3234043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).