1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one

C10H17NO — CID 143588066

IUPAC1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one
SMILESCCCC1=C(C)C(=O)N(C)CC1
InChIInChI=1S/C10H17NO/c1-4-5-9-6-7-11(3)10(12)8(9)2/h4-7H2,1-3H3
InChIKeyUMTJHIIQDSGLBL-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.97
Rot. Bonds2

About 1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one

1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one (PubChem CID 143588066) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one.

Molecular Properties

Compound Name1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one
PubChem CID143588066
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one
SMILESCCCC1=C(C)C(=O)N(C)CC1
InChIInChI=1S/C10H17NO/c1-4-5-9-6-7-11(3)10(12)8(9)2/h4-7H2,1-3H3
InChIKeyUMTJHIIQDSGLBL-UHFFFAOYSA-N
XLogP1.97
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-butyl-1-methyl-2H-pyrrol-5-one
CID 10844585
1,4,5-Trimethyl-2,3-dihydropyridin-6-one
CID 15981614
a-Geranylpiperidine
CID 129763847
4-Butyl-1-tert-butyl-2,3-dihydropyridin-6-one
CID 135038598
N,N-dibutyl-2-cyclohexylidene-3,3,3-trifluoropropanamide
CID 10947134
(4-Ethyl-2,5-dimethylcyclopenta-1,4-dien-1-yl)-(4-fluoropiperidin-1-yl)methanone
CID 153557051
(E)-N,N,2-triethylhept-2-enamide
CID 102303653
N,N,3-triethyl-2-methylpent-2-enamide
CID 102303654
2-cyclohexylidene-N,N-diethylpropanamide
CID 102303656
(E)-N,N-diethyl-2,3-dimethylhex-2-enamide
CID 102303658
1-Butyl-4,5-ditert-butyl-2,3-dihydropyridin-6-one
CID 20871976
4,5-Ditert-butyl-1-methyl-2,3-dihydropyridin-6-one
CID 23398291

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one?
The IUPAC name of 1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one (CID 143588066) is 1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one.
What is the SMILES notation for 1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one?
The canonical SMILES for 1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one is CCCC1=C(C)C(=O)N(C)CC1.
What is the InChIKey of 1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one?
The InChIKey is UMTJHIIQDSGLBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-4-5-9-6-7-11(3)10(12)8(9)2/h4-7H2,1-3H3.
What are the key properties of 1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one?
1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one has a molecular weight of 167.25 g/mol, XLogP of 1.97, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-4-propyl-2,3-dihydropyridin-6-one is sourced from PubChem (CID 143588066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).