6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide

C21H26N4O2 — CID 48657361

IUPAC6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide
SMILESCCN(CC)c1ccc(C(=O)Nc2cccc(CN3CCCC3=O)c2)cn1
InChIInChI=1S/C21H26N4O2/c1-3-24(4-2)19-11-10-17(14-22-19)21(27)23-18-8-5-7-16(13-18)15-25-12-6-9-20(25)26/h5,7-8,10-11,13-14H,3-4,6,9,12,15H2,1-2H3,(H,23,27)
InChIKeyVYRBRPXXOHHVKS-UHFFFAOYSA-N
MW366.47 g/mol
LogP3.30
Rot. Bonds7

About 6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide

6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide (PubChem CID 48657361) has the molecular formula C21H26N4O2 and a molecular weight of 366.47 g/mol. Its IUPAC name is 6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide
PubChem CID48657361
Molecular FormulaC21H26N4O2
Molecular Weight366.47 g/mol
Exact Mass366.21
IUPAC Name6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide
SMILESCCN(CC)c1ccc(C(=O)Nc2cccc(CN3CCCC3=O)c2)cn1
InChIInChI=1S/C21H26N4O2/c1-3-24(4-2)19-11-10-17(14-22-19)21(27)23-18-8-5-7-16(13-18)15-25-12-6-9-20(25)26/h5,7-8,10-11,13-14H,3-4,6,9,12,15H2,1-2H3,(H,23,27)
InChIKeyVYRBRPXXOHHVKS-UHFFFAOYSA-N
XLogP3.30
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5,6-dichloro-N-[3-[(2-oxopiperidin-1-yl)methyl]phenyl]pyridine-3-carboxamide
CID 49359891
[2-formyl-4-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]carbamoyl]phenyl]boronic acid
CID 166430535
3-ethoxy-N-[3-[(2-oxopiperidin-1-yl)methyl]phenyl]-4-propoxybenzamide
CID 49360580
6-(diethylamino)-N-[3-(oxan-4-ylsulfanylmethyl)phenyl]pyridine-3-carboxamide
CID 86961518
4-chloro-3-(diethylsulfamoyl)-N-[3-[(2-oxopiperidin-1-yl)methyl]phenyl]benzamide
CID 47088014
3-[(2-methylcyclopropanecarbonyl)amino]-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]benzamide
CID 55651425
3-amino-N-[3-[(2-oxopiperidin-1-yl)methyl]phenyl]benzamide
CID 119759695
4-[(2-oxopyrrolidin-1-yl)methyl]-N-(3-propan-2-ylphenyl)benzamide
CID 8732907
N-[3-[[(2S)-2-methylpiperidin-1-yl]methyl]phenyl]-3-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 92627414
N-(3,4-dipropoxyphenyl)-3-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 9376524
N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]hexanamide
CID 37359459
N-(3-ethylphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 27256400

Frequently Asked Questions

What is the IUPAC name of 6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide?
The IUPAC name of 6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide (CID 48657361) is 6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide?
The canonical SMILES for 6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide is CCN(CC)c1ccc(C(=O)Nc2cccc(CN3CCCC3=O)c2)cn1.
What is the InChIKey of 6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide?
The InChIKey is VYRBRPXXOHHVKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O2/c1-3-24(4-2)19-11-10-17(14-22-19)21(27)23-18-8-5-7-16(13-18)15-25-12-6-9-20(25)26/h5,7-8,10-11,13-14H,3-4,6,9,12,15H2,1-2H3,(H,23,27).
What are the key properties of 6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide?
6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide has a molecular weight of 366.47 g/mol, XLogP of 3.30, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(diethylamino)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 48657361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).