5-cyclopropyl-7,8-dihydropteridin-6-one

C9H10N4O — CID 175812763

IUPAC5-cyclopropyl-7,8-dihydropteridin-6-one
SMILESO=C1CNc2ncncc2N1C1CC1
InChIInChI=1S/C9H10N4O/c14-8-4-11-9-7(3-10-5-12-9)13(8)6-1-2-6/h3,5-6H,1-2,4H2,(H,10,11,12)
InChIKeyPRZHZISXIINFMQ-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.40
Rot. Bonds1

About 5-cyclopropyl-7,8-dihydropteridin-6-one

5-cyclopropyl-7,8-dihydropteridin-6-one (PubChem CID 175812763) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 5-cyclopropyl-7,8-dihydropteridin-6-one.

Molecular Properties

Compound Name5-cyclopropyl-7,8-dihydropteridin-6-one
PubChem CID175812763
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name5-cyclopropyl-7,8-dihydropteridin-6-one
SMILESO=C1CNc2ncncc2N1C1CC1
InChIInChI=1S/C9H10N4O/c14-8-4-11-9-7(3-10-5-12-9)13(8)6-1-2-6/h3,5-6H,1-2,4H2,(H,10,11,12)
InChIKeyPRZHZISXIINFMQ-UHFFFAOYSA-N
XLogP0.40
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-7,8-dihydropteridin-6-one?
The IUPAC name of 5-cyclopropyl-7,8-dihydropteridin-6-one (CID 175812763) is 5-cyclopropyl-7,8-dihydropteridin-6-one.
What is the SMILES notation for 5-cyclopropyl-7,8-dihydropteridin-6-one?
The canonical SMILES for 5-cyclopropyl-7,8-dihydropteridin-6-one is O=C1CNc2ncncc2N1C1CC1.
What is the InChIKey of 5-cyclopropyl-7,8-dihydropteridin-6-one?
The InChIKey is PRZHZISXIINFMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c14-8-4-11-9-7(3-10-5-12-9)13(8)6-1-2-6/h3,5-6H,1-2,4H2,(H,10,11,12).
What are the key properties of 5-cyclopropyl-7,8-dihydropteridin-6-one?
5-cyclopropyl-7,8-dihydropteridin-6-one has a molecular weight of 190.21 g/mol, XLogP of 0.40, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-7,8-dihydropteridin-6-one is sourced from PubChem (CID 175812763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).