4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one

C10H17N3O — CID 21311519

IUPAC4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one
SMILESCCN(CC)c1nc(=O)[nH]c(C)c1C
InChIInChI=1S/C10H17N3O/c1-5-13(6-2)9-7(3)8(4)11-10(14)12-9/h5-6H2,1-4H3,(H,11,12,14)
InChIKeyBEKNFCBZQDTXGO-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.23
Rot. Bonds3

About 4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one

4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one (PubChem CID 21311519) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one.

Molecular Properties

Compound Name4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one
PubChem CID21311519
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one
SMILESCCN(CC)c1nc(=O)[nH]c(C)c1C
InChIInChI=1S/C10H17N3O/c1-5-13(6-2)9-7(3)8(4)11-10(14)12-9/h5-6H2,1-4H3,(H,11,12,14)
InChIKeyBEKNFCBZQDTXGO-UHFFFAOYSA-N
XLogP1.23
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 21311513
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CID 22948985
CID 22948985
CID 54259998
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CID 71273347
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CID 147922803
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CID 13789835
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CID 54259999
CID 54259999
CID 83862269
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CID 83863070
CID 83863070

Frequently Asked Questions

What is the IUPAC name of 4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one?
The IUPAC name of 4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one (CID 21311519) is 4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one.
What is the SMILES notation for 4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one?
The canonical SMILES for 4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one is CCN(CC)c1nc(=O)[nH]c(C)c1C.
What is the InChIKey of 4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one?
The InChIKey is BEKNFCBZQDTXGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-5-13(6-2)9-7(3)8(4)11-10(14)12-9/h5-6H2,1-4H3,(H,11,12,14).
What are the key properties of 4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one?
4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one has a molecular weight of 195.27 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one is sourced from PubChem (CID 21311519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).