N-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide

C20H21N3O2 — CID 110662860

IUPACN-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide
SMILESCC(C)c1ccc2[nH]c(=O)c(CCNC(=O)c3ccccn3)cc2c1
InChIInChI=1S/C20H21N3O2/c1-13(2)14-6-7-17-16(11-14)12-15(19(24)23-17)8-10-22-20(25)18-5-3-4-9-21-18/h3-7,9,11-13H,8,10H2,1-2H3,(H,22,25)(H,23,24)
InChIKeyFQYLZJWUMDUBHC-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.02
Rot. Bonds5

About N-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide

N-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide (PubChem CID 110662860) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is N-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide
PubChem CID110662860
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC NameN-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide
SMILESCC(C)c1ccc2[nH]c(=O)c(CCNC(=O)c3ccccn3)cc2c1
InChIInChI=1S/C20H21N3O2/c1-13(2)14-6-7-17-16(11-14)12-15(19(24)23-17)8-10-22-20(25)18-5-3-4-9-21-18/h3-7,9,11-13H,8,10H2,1-2H3,(H,22,25)(H,23,24)
InChIKeyFQYLZJWUMDUBHC-UHFFFAOYSA-N
XLogP3.02
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide
CID 110662758
1-(2,2-dimethylpropyl)-3-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]urea
CID 110662870
N-[3-(dimethylamino)propyl]-3-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)propanamide
CID 110331789
N-[2-(2-propan-2-yl-3H-benzimidazol-5-yl)ethyl]pyridine-2-carboxamide
CID 110796141
2-(2-methoxyphenoxy)-N-[(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)methyl]acetamide
CID 110325585
2-(4-chlorophenoxy)-N-[(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)methyl]acetamide
CID 110325570
N-[2-(2-hydroxyphenyl)ethyl]pyridine-2-carboxamide
CID 110672365
N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]benzamide
CID 110326009
2-(2-oxo-1H-quinolin-3-yl)-N-[2-(1H-pyrrolo[3,2-b]pyridin-3-yl)ethyl]acetamide
CID 166340165
N-[2-(2-methoxy-4,5-dimethylphenyl)ethyl]pyridine-2-carboxamide
CID 110795315
N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-2-methylbenzamide
CID 4077939
N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-3-carboxamide
CID 110326044

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide?
The IUPAC name of N-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide (CID 110662860) is N-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for N-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide is CC(C)c1ccc2[nH]c(=O)c(CCNC(=O)c3ccccn3)cc2c1.
What is the InChIKey of N-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide?
The InChIKey is FQYLZJWUMDUBHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-13(2)14-6-7-17-16(11-14)12-15(19(24)23-17)8-10-22-20(25)18-5-3-4-9-21-18/h3-7,9,11-13H,8,10H2,1-2H3,(H,22,25)(H,23,24).
What are the key properties of N-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide?
N-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 335.41 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 110662860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).