8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one

C10H15N5O — CID 171384841

IUPAC8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one
SMILESCCNc1ncc2c(n1)N(CC)C(=O)CN2
InChIInChI=1S/C10H15N5O/c1-3-11-10-13-5-7-9(14-10)15(4-2)8(16)6-12-7/h5,12H,3-4,6H2,1-2H3,(H,11,13,14)
InChIKeyUKVQRZYCQOVJPN-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.69
Rot. Bonds3

About 8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one

8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one (PubChem CID 171384841) has the molecular formula C10H15N5O and a molecular weight of 221.26 g/mol. Its IUPAC name is 8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one.

Molecular Properties

Compound Name8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one
PubChem CID171384841
Molecular FormulaC10H15N5O
Molecular Weight221.26 g/mol
Exact Mass221.13
IUPAC Name8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one
SMILESCCNc1ncc2c(n1)N(CC)C(=O)CN2
InChIInChI=1S/C10H15N5O/c1-3-11-10-13-5-7-9(14-10)15(4-2)8(16)6-12-7/h5,12H,3-4,6H2,1-2H3,(H,11,13,14)
InChIKeyUKVQRZYCQOVJPN-UHFFFAOYSA-N
XLogP0.69
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one?
The IUPAC name of 8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one (CID 171384841) is 8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one.
What is the SMILES notation for 8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one?
The canonical SMILES for 8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one is CCNc1ncc2c(n1)N(CC)C(=O)CN2.
What is the InChIKey of 8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one?
The InChIKey is UKVQRZYCQOVJPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O/c1-3-11-10-13-5-7-9(14-10)15(4-2)8(16)6-12-7/h5,12H,3-4,6H2,1-2H3,(H,11,13,14).
What are the key properties of 8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one?
8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one has a molecular weight of 221.26 g/mol, XLogP of 0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-2-(ethylamino)-5,6-dihydropteridin-7-one is sourced from PubChem (CID 171384841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).