ethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide

C13H22N2O2 — CID 142476326

IUPACethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide
SMILESCC.CCNC(=O)c1c(C)[nH]c(=O)c(C)c1C
InChIInChI=1S/C11H16N2O2.C2H6/c1-5-12-11(15)9-6(2)7(3)10(14)13-8(9)4;1-2/h5H2,1-4H3,(H,12,15)(H,13,14);1-2H3
InChIKeyKLWGMYRFADPIQT-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.08
Rot. Bonds2

About ethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide

ethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 142476326) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is ethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Nameethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide
PubChem CID142476326
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Nameethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide
SMILESCC.CCNC(=O)c1c(C)[nH]c(=O)c(C)c1C
InChIInChI=1S/C11H16N2O2.C2H6/c1-5-12-11(15)9-6(2)7(3)10(14)13-8(9)4;1-2/h5H2,1-4H3,(H,12,15)(H,13,14);1-2H3
InChIKeyKLWGMYRFADPIQT-UHFFFAOYSA-N
XLogP2.08
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N3,N5-dibutyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxamide
CID 376647
N,5,6-trimethyl-N-[(2S)-4-(methylamino)-4-oxobutan-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 97894384
N,1,2,4-tetramethyl-6-oxopyridine-3-carboxamide
CID 10921409
N,1-dibutyl-2,4-dimethyl-6-oxopyridine-3-carboxamide
CID 12920965
2,4-dimethyl-N,1-bis(2-methylbutyl)-6-oxopyridine-3-carboxamide
CID 12920969
N-Ethyl-1,6-dihydro-4-methyl-6-oxo-3-pyridinecarboxamide
CID 133634244
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]propanamide
CID 16342672
(E)-3-amino-2-ethyl-N-propylpent-2-enamide
CID 21652620
(E)-3-amino-N-butyl-2-ethylpent-2-enamide
CID 21693058
3,7-Dimethyl-2-propan-2-yl-1,5-dihydropyrrolo[3,2-c]pyridin-6-one
CID 22091765
(Z)-3-(ethylamino)-2-methylpent-2-enamide
CID 23183833
(Z)-3-amino-N,2-dipropylhex-2-enamide
CID 23183834

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of ethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide (CID 142476326) is ethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for ethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for ethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide is CC.CCNC(=O)c1c(C)[nH]c(=O)c(C)c1C.
What is the InChIKey of ethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is KLWGMYRFADPIQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2.C2H6/c1-5-12-11(15)9-6(2)7(3)10(14)13-8(9)4;1-2/h5H2,1-4H3,(H,12,15)(H,13,14);1-2H3.
What are the key properties of ethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide?
ethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 238.33 g/mol, XLogP of 2.08, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethyl-2,4,5-trimethyl-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 142476326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).