N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride

C16H22ClN3O3 — CID 119606209

IUPACN-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride
SMILESCC(C)C(C)(CN)NC(=O)c1ccc(-c2ccco2)[nH]c1=O.Cl
InChIInChI=1S/C16H21N3O3.ClH/c1-10(2)16(3,9-17)19-15(21)11-6-7-12(18-14(11)20)13-5-4-8-22-13;/h4-8,10H,9,17H2,1-3H3,(H,18,20)(H,19,21);1H
InChIKeyWVSWSRKUZDSEJD-UHFFFAOYSA-N
MW339.82 g/mol
LogP2.16
Rot. Bonds5

About N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride

N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride (PubChem CID 119606209) has the molecular formula C16H22ClN3O3 and a molecular weight of 339.82 g/mol. Its IUPAC name is N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride
PubChem CID119606209
Molecular FormulaC16H22ClN3O3
Molecular Weight339.82 g/mol
Exact Mass339.13
IUPAC NameN-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride
SMILESCC(C)C(C)(CN)NC(=O)c1ccc(-c2ccco2)[nH]c1=O.Cl
InChIInChI=1S/C16H21N3O3.ClH/c1-10(2)16(3,9-17)19-15(21)11-6-7-12(18-14(11)20)13-5-4-8-22-13;/h4-8,10H,9,17H2,1-3H3,(H,18,20)(H,19,21);1H
InChIKeyWVSWSRKUZDSEJD-UHFFFAOYSA-N
XLogP2.16
TPSA101.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.82
LogP ≤ 52.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride with MolForge

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Related Compounds

N-(1-amino-2,3-dimethylbutan-2-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride
CID 119607556
2-[[6-(furan-2-yl)-2-oxo-1H-pyridine-3-carbonyl]amino]-2-methylpentanoic acid
CID 120517072
N-(3-aminobutyl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide
CID 119495794
6-(furan-2-yl)-N-[(2R)-1-hydroxy-3,3-dimethylbutan-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 125139391
6-(furan-2-yl)-N-(3-methylbutyl)-2-oxo-1H-pyridine-3-carboxamide
CID 47459019
6-(furan-2-yl)-N-[4-(furan-2-yl)butan-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 56821017
6-(furan-2-yl)-N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 138041587
6-(furan-2-yl)-N-[(2S,3R)-1-hydroxy-3-phenylbutan-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 97255840
6-(furan-2-yl)-2-oxo-N-[4-(propan-2-ylcarbamoylamino)phenyl]-1H-pyridine-3-carboxamide
CID 86858643
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide
CID 95977473
N-(1-amino-2,3-dimethylbutan-2-yl)-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide;hydrochloride
CID 119607727
N-(1-amino-2,3-dimethylbutan-2-yl)-2,4-dimethoxybenzamide;hydrochloride
CID 119606880

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride?
The IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride (CID 119606209) is N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride is CC(C)C(C)(CN)NC(=O)c1ccc(-c2ccco2)[nH]c1=O.Cl.
What is the InChIKey of N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride?
The InChIKey is WVSWSRKUZDSEJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3.ClH/c1-10(2)16(3,9-17)19-15(21)11-6-7-12(18-14(11)20)13-5-4-8-22-13;/h4-8,10H,9,17H2,1-3H3,(H,18,20)(H,19,21);1H.
What are the key properties of N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride?
N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride has a molecular weight of 339.82 g/mol, XLogP of 2.16, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,3-dimethylbutan-2-yl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119606209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).