2-(dimethylamino)-8-ethylpteridin-7-one

C10H13N5O — CID 171384049

IUPAC2-(dimethylamino)-8-ethylpteridin-7-one
SMILESCCn1c(=O)cnc2cnc(N(C)C)nc21
InChIInChI=1S/C10H13N5O/c1-4-15-8(16)6-11-7-5-12-10(14(2)3)13-9(7)15/h5-6H,4H2,1-3H3
InChIKeyMQTFFLSRYUSVOP-UHFFFAOYSA-N
MW219.25 g/mol
LogP0.27
Rot. Bonds2

About 2-(dimethylamino)-8-ethylpteridin-7-one

2-(dimethylamino)-8-ethylpteridin-7-one (PubChem CID 171384049) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 2-(dimethylamino)-8-ethylpteridin-7-one.

Molecular Properties

Compound Name2-(dimethylamino)-8-ethylpteridin-7-one
PubChem CID171384049
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name2-(dimethylamino)-8-ethylpteridin-7-one
SMILESCCn1c(=O)cnc2cnc(N(C)C)nc21
InChIInChI=1S/C10H13N5O/c1-4-15-8(16)6-11-7-5-12-10(14(2)3)13-9(7)15/h5-6H,4H2,1-3H3
InChIKeyMQTFFLSRYUSVOP-UHFFFAOYSA-N
XLogP0.27
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-8-ethylpteridin-7-one?
The IUPAC name of 2-(dimethylamino)-8-ethylpteridin-7-one (CID 171384049) is 2-(dimethylamino)-8-ethylpteridin-7-one.
What is the SMILES notation for 2-(dimethylamino)-8-ethylpteridin-7-one?
The canonical SMILES for 2-(dimethylamino)-8-ethylpteridin-7-one is CCn1c(=O)cnc2cnc(N(C)C)nc21.
What is the InChIKey of 2-(dimethylamino)-8-ethylpteridin-7-one?
The InChIKey is MQTFFLSRYUSVOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-4-15-8(16)6-11-7-5-12-10(14(2)3)13-9(7)15/h5-6H,4H2,1-3H3.
What are the key properties of 2-(dimethylamino)-8-ethylpteridin-7-one?
2-(dimethylamino)-8-ethylpteridin-7-one has a molecular weight of 219.25 g/mol, XLogP of 0.27, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-8-ethylpteridin-7-one is sourced from PubChem (CID 171384049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).