5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one

C15H21NO — CID 70833117

IUPAC5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one
SMILESCc1[nH]c(=O)c(C)cc1/C=C\C1C(C)CC1C
InChIInChI=1S/C15H21NO/c1-9-7-10(2)14(9)6-5-13-8-11(3)15(17)16-12(13)4/h5-6,8-10,14H,7H2,1-4H3,(H,16,17)/b6-5-
InChIKeyFKZOPQMCLZBHMU-WAYWQWQTSA-N
MW231.34 g/mol
LogP3.30
Rot. Bonds2

About 5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one

5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one (PubChem CID 70833117) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one.

Molecular Properties

Compound Name5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one
PubChem CID70833117
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one
SMILESCc1[nH]c(=O)c(C)cc1/C=C\C1C(C)CC1C
InChIInChI=1S/C15H21NO/c1-9-7-10(2)14(9)6-5-13-8-11(3)15(17)16-12(13)4/h5-6,8-10,14H,7H2,1-4H3,(H,16,17)/b6-5-
InChIKeyFKZOPQMCLZBHMU-WAYWQWQTSA-N
XLogP3.30
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one with MolForge

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Related Compounds

5-(2-methylpropanoyl)-6-propan-2-yl-1H-pyridin-2-one
CID 13572416
(2E)-N-tert-butyl-4-cyclobutylpenta-2,4-dienamide
CID 102084154
3-methyl-6-(2,4,4-trimethylpentyl)-1H-pyridin-2-one
CID 17864869
6-(2,3-dimethylhexan-2-yl)-4-methyl-1H-pyridin-2-one
CID 18436381
6-(2,4,4-trimethylpentyl)-1H-pyridin-2-one
CID 19800564
5,6-di(propan-2-yl)-1H-pyridin-2-one
CID 23393317
3-methyl-5,6-di(propan-2-yl)-1H-pyridin-2-one
CID 58327584
4-methyl-5,6-di(propan-2-yl)-1H-pyridin-2-one
CID 58327598
4-butan-2-yl-3,5,6-trimethyl-1H-pyridin-2-one
CID 68198301
N-[(1Z,3E)-1-(2-methylcyclobutyl)penta-1,3-dien-3-yl]acetamide
CID 88991014
6-hexan-2-yl-5-methyl-1H-pyridin-2-one
CID 89260937
5-methyl-6-pentan-2-yl-1H-pyridin-2-one
CID 89301018

Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one?
The IUPAC name of 5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one (CID 70833117) is 5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one.
What is the SMILES notation for 5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one?
The canonical SMILES for 5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one is Cc1[nH]c(=O)c(C)cc1/C=C\C1C(C)CC1C.
What is the InChIKey of 5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one?
The InChIKey is FKZOPQMCLZBHMU-WAYWQWQTSA-N. The full InChI is InChI=1S/C15H21NO/c1-9-7-10(2)14(9)6-5-13-8-11(3)15(17)16-12(13)4/h5-6,8-10,14H,7H2,1-4H3,(H,16,17)/b6-5-.
What are the key properties of 5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one?
5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one has a molecular weight of 231.34 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-3,6-dimethyl-1H-pyridin-2-one is sourced from PubChem (CID 70833117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).