2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one

C10H17N3O — CID 58091021

IUPAC2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one
SMILESCCc1cnc(N(CC)CC)[nH]c1=O
InChIInChI=1S/C10H17N3O/c1-4-8-7-11-10(12-9(8)14)13(5-2)6-3/h7H,4-6H2,1-3H3,(H,11,12,14)
InChIKeyYISOQPNCPFSIAN-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.18
Rot. Bonds4

About 2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one

2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one (PubChem CID 58091021) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one
PubChem CID58091021
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one
SMILESCCc1cnc(N(CC)CC)[nH]c1=O
InChIInChI=1S/C10H17N3O/c1-4-8-7-11-10(12-9(8)14)13(5-2)6-3/h7H,4-6H2,1-3H3,(H,11,12,14)
InChIKeyYISOQPNCPFSIAN-UHFFFAOYSA-N
XLogP1.18
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one?
The IUPAC name of 2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one (CID 58091021) is 2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one?
The canonical SMILES for 2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one is CCc1cnc(N(CC)CC)[nH]c1=O.
What is the InChIKey of 2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one?
The InChIKey is YISOQPNCPFSIAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-4-8-7-11-10(12-9(8)14)13(5-2)6-3/h7H,4-6H2,1-3H3,(H,11,12,14).
What are the key properties of 2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one?
2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one has a molecular weight of 195.27 g/mol, XLogP of 1.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one is sourced from PubChem (CID 58091021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).