3,4,5,6-tetramethyl-1H-pyridin-2-one

C9H13NO — CID 13433062

IUPAC3,4,5,6-tetramethyl-1H-pyridin-2-one
SMILESCc1[nH]c(=O)c(C)c(C)c1C
InChIInChI=1S/C9H13NO/c1-5-6(2)8(4)10-9(11)7(5)3/h1-4H3,(H,10,11)
InChIKeySVRMGDULMMTCIL-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.61
Rot. Bonds

About 3,4,5,6-tetramethyl-1H-pyridin-2-one

3,4,5,6-tetramethyl-1H-pyridin-2-one (PubChem CID 13433062) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 3,4,5,6-tetramethyl-1H-pyridin-2-one.

Molecular Properties

Compound Name3,4,5,6-tetramethyl-1H-pyridin-2-one
PubChem CID13433062
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name3,4,5,6-tetramethyl-1H-pyridin-2-one
SMILESCc1[nH]c(=O)c(C)c(C)c1C
InChIInChI=1S/C9H13NO/c1-5-6(2)8(4)10-9(11)7(5)3/h1-4H3,(H,10,11)
InChIKeySVRMGDULMMTCIL-UHFFFAOYSA-N
XLogP1.61
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,4,5,6-tetramethyl-1H-pyridin-2-one?
The IUPAC name of 3,4,5,6-tetramethyl-1H-pyridin-2-one (CID 13433062) is 3,4,5,6-tetramethyl-1H-pyridin-2-one.
What is the SMILES notation for 3,4,5,6-tetramethyl-1H-pyridin-2-one?
The canonical SMILES for 3,4,5,6-tetramethyl-1H-pyridin-2-one is Cc1[nH]c(=O)c(C)c(C)c1C.
What is the InChIKey of 3,4,5,6-tetramethyl-1H-pyridin-2-one?
The InChIKey is SVRMGDULMMTCIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-5-6(2)8(4)10-9(11)7(5)3/h1-4H3,(H,10,11).
What are the key properties of 3,4,5,6-tetramethyl-1H-pyridin-2-one?
3,4,5,6-tetramethyl-1H-pyridin-2-one has a molecular weight of 151.21 g/mol, XLogP of 1.61, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5,6-tetramethyl-1H-pyridin-2-one is sourced from PubChem (CID 13433062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).