N-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide

C16H20N2O2 — CID 107261645

IUPACN-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESO=C(NC12CC3CC(CC(C3)C1)C2)c1cccc(=O)[nH]1
InChIInChI=1S/C16H20N2O2/c19-14-3-1-2-13(17-14)15(20)18-16-7-10-4-11(8-16)6-12(5-10)9-16/h1-3,10-12H,4-9H2,(H,17,19)(H,18,20)
InChIKeyWEVFFDPYEOLLFU-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.07
Rot. Bonds2

About N-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide

N-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide (PubChem CID 107261645) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide
PubChem CID107261645
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESO=C(NC12CC3CC(CC(C3)C1)C2)c1cccc(=O)[nH]1
InChIInChI=1S/C16H20N2O2/c19-14-3-1-2-13(17-14)15(20)18-16-7-10-4-11(8-16)6-12(5-10)9-16/h1-3,10-12H,4-9H2,(H,17,19)(H,18,20)
InChIKeyWEVFFDPYEOLLFU-UHFFFAOYSA-N
XLogP2.07
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-oxo-N-[1-(trifluoromethyl)cyclopropyl]-1H-pyridine-2-carboxamide
CID 106213890
N-(3-amino-2,2-dimethylcyclobutyl)-6-oxo-1H-pyridine-2-carboxamide
CID 114040543
N-(1-adamantyl)-2-fluoro-6-hydroxybenzamide
CID 104916407
N-(1-adamantyl)-4-sulfanylbenzamide
CID 107019898
N-(1-adamantyl)-4-chlorobenzamide
CID 2848134
N-(1-adamantyl)-4-(aminomethyl)benzamide;hydrochloride
CID 119261555
N-(1-adamantyl)-4-oxo-1H-pyridine-3-carboxamide
CID 103337054
N-cyclohex-3-en-1-yl-6-oxo-1H-pyridine-2-carboxamide
CID 107363122
N-(1-adamantyl)-2-(trifluoromethyl)benzamide
CID 3118948
1-N,3-N-bis(1-adamantyl)-5-aminobenzene-1,3-dicarboxamide
CID 57309710
4-acetamido-N-(1-adamantyl)benzamide
CID 7732501
N-(4-methylsulfanylcyclohexyl)-6-oxo-1H-pyridine-2-carboxamide
CID 114124257

Frequently Asked Questions

What is the IUPAC name of N-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of N-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide (CID 107261645) is N-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for N-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for N-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide is O=C(NC12CC3CC(CC(C3)C1)C2)c1cccc(=O)[nH]1.
What is the InChIKey of N-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide?
The InChIKey is WEVFFDPYEOLLFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c19-14-3-1-2-13(17-14)15(20)18-16-7-10-4-11(8-16)6-12(5-10)9-16/h1-3,10-12H,4-9H2,(H,17,19)(H,18,20).
What are the key properties of N-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide?
N-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 2.07, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)-6-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 107261645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).