2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide

C14H21N3O2 — CID 74244916

IUPAC2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide
SMILESCCc1cc(C(=O)NCC2CCCNC2)cc(=O)[nH]1
InChIInChI=1S/C14H21N3O2/c1-2-12-6-11(7-13(18)17-12)14(19)16-9-10-4-3-5-15-8-10/h6-7,10,15H,2-5,8-9H2,1H3,(H,16,19)(H,17,18)
InChIKeyKMEXAUCXMHHHKR-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.67
Rot. Bonds4

About 2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide

2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide (PubChem CID 74244916) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide.

Molecular Properties

Compound Name2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide
PubChem CID74244916
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide
SMILESCCc1cc(C(=O)NCC2CCCNC2)cc(=O)[nH]1
InChIInChI=1S/C14H21N3O2/c1-2-12-6-11(7-13(18)17-12)14(19)16-9-10-4-3-5-15-8-10/h6-7,10,15H,2-5,8-9H2,1H3,(H,16,19)(H,17,18)
InChIKeyKMEXAUCXMHHHKR-UHFFFAOYSA-N
XLogP0.67
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

9-Vinyl-1,2,3,4,5,6-hexahydro-1,5-methano-pyrido[1,2-a][1,5]diazocin-8-one
CID 10220032
(-)-9-Methylcytisine
CID 21139629
US11667638, Example 148
CID 146646317
US11667638, Example 142
CID 153497003
2-hydroxy-6-methyl-N-propyl-5,6,7,8-tetrahydroquinoline-3-carboxamide
CID 51054875
N-({1-[(2E)-2-methylpent-2-en-1-yl]piperidin-4-yl}methyl)-6-oxo-1,6-dihydropyridine-3-carboxamide
CID 56710306
6-(2-methylpropyl)-4-(4-pyrrolidin-1-ylpiperidine-1-carbonyl)-1H-pyridin-2-one
CID 75446961
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methylpropanamide
CID 41506759
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methylpent-2-enamide
CID 72155658
N-[(1S*,3R*)-3-aminocyclopentyl]-6-ethyl-2-oxo-1,2-dihydropyridine-4-carboxamide
CID 74245774
N-[(3-hydroxypiperidin-3-yl)methyl]-6-methyl-2-oxo-1,2-dihydropyridine-4-carboxamide
CID 77094414
N-[(2S)-2-(4-methylpiperazin-1-yl)propyl]-2-(2-methylpropyl)-6-oxo-1H-pyridine-4-carboxamide
CID 97611746

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide?
The IUPAC name of 2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide (CID 74244916) is 2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide.
What is the SMILES notation for 2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide?
The canonical SMILES for 2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide is CCc1cc(C(=O)NCC2CCCNC2)cc(=O)[nH]1.
What is the InChIKey of 2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide?
The InChIKey is KMEXAUCXMHHHKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-2-12-6-11(7-13(18)17-12)14(19)16-9-10-4-3-5-15-8-10/h6-7,10,15H,2-5,8-9H2,1H3,(H,16,19)(H,17,18).
What are the key properties of 2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide?
2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 0.67, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-oxo-N-(piperidin-3-ylmethyl)-1H-pyridine-4-carboxamide is sourced from PubChem (CID 74244916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).