N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide

C16H22N2O3 — CID 87461192

IUPACN-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide
SMILESO=C1CCC=CN1N(O)C(=O)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C16H22N2O3/c19-14-3-1-2-4-17(14)18(21)15(20)16-8-11-5-12(9-16)7-13(6-11)10-16/h2,4,11-13,21H,1,3,5-10H2
InChIKeyOEVNRDZYPCAXIC-UHFFFAOYSA-N
MW290.36 g/mol
LogP2.47
Rot. Bonds2

About N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide

N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide (PubChem CID 87461192) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide.

Molecular Properties

Compound NameN-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide
PubChem CID87461192
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC NameN-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide
SMILESO=C1CCC=CN1N(O)C(=O)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C16H22N2O3/c19-14-3-1-2-4-17(14)18(21)15(20)16-8-11-5-12(9-16)7-13(6-11)10-16/h2,4,11-13,21H,1,3,5-10H2
InChIKeyOEVNRDZYPCAXIC-UHFFFAOYSA-N
XLogP2.47
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-[adamantane-1-carbonyl(1-adamantyl)amino]phenyl]-N-(1-adamantyl)adamantane-1-carboxamide
CID 171577021
1-(adamantane-1-carbonyl)piperidin-2-one
CID 153488108
N-[(4-anilinophenyl)methyl]-N-hydroxyadamantane-1-carboxamide
CID 166062124
(2-oxopyrrolidin-1-yl) adamantane-1-carboxylate
CID 123232829
N,N-bis(2-hydroxyethyl)adamantane-1-carboxamide
CID 60653107
N-cyclohexyl-N-[1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]adamantane-1-carboxamide
CID 23832441
N-(3-cyano-2-hydroxy-4-methyl-6-oxo-1-pyridinyl)-N-methyladamantane-1-carboxamide
CID 123841753
N-[(1E,4Z,7E)-8-(adamantane-1-carbonylamino)cycloocta-1,4,7-trien-1-yl]adamantane-1-carboxamide
CID 171577222
N-cyclopropyl-N-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]adamantane-1-carboxamide
CID 23774586
N-[4-[adamantane-1-carbonyl(1-adamantyl)amino]cyclohexyl]-N-(1-adamantyl)adamantane-1-carboxamide
CID 171722407
N-phenyl-N-propan-2-yladamantane-1-carboxamide
CID 20800672
1'-(adamantane-1-carbonyl)-6-chlorospiro[3H-chromene-2,4'-piperidine]-4-one
CID 108735105

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide?
The IUPAC name of N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide (CID 87461192) is N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide.
What is the SMILES notation for N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide?
The canonical SMILES for N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide is O=C1CCC=CN1N(O)C(=O)C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide?
The InChIKey is OEVNRDZYPCAXIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c19-14-3-1-2-4-17(14)18(21)15(20)16-8-11-5-12(9-16)7-13(6-11)10-16/h2,4,11-13,21H,1,3,5-10H2.
What are the key properties of N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide?
N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide has a molecular weight of 290.36 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N-(2-oxo-3,4-dihydropyridin-1-yl)adamantane-1-carboxamide is sourced from PubChem (CID 87461192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).