1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide

C15H19FN4O2 — CID 142414572

IUPAC1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide
SMILESCN(C)C(=O)C1CN(c2ncc(N3CCCC3=O)cc2F)C1
InChIInChI=1S/C15H19FN4O2/c1-18(2)15(22)10-8-19(9-10)14-12(16)6-11(7-17-14)20-5-3-4-13(20)21/h6-7,10H,3-5,8-9H2,1-2H3
InChIKeyYNWGCUFDUHCSNT-UHFFFAOYSA-N
MW306.34 g/mol
LogP0.87
Rot. Bonds3

About 1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide

1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide (PubChem CID 142414572) has the molecular formula C15H19FN4O2 and a molecular weight of 306.34 g/mol. Its IUPAC name is 1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide.

Molecular Properties

Compound Name1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide
PubChem CID142414572
Molecular FormulaC15H19FN4O2
Molecular Weight306.34 g/mol
Exact Mass306.15
IUPAC Name1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide
SMILESCN(C)C(=O)C1CN(c2ncc(N3CCCC3=O)cc2F)C1
InChIInChI=1S/C15H19FN4O2/c1-18(2)15(22)10-8-19(9-10)14-12(16)6-11(7-17-14)20-5-3-4-13(20)21/h6-7,10H,3-5,8-9H2,1-2H3
InChIKeyYNWGCUFDUHCSNT-UHFFFAOYSA-N
XLogP0.87
TPSA56.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.34
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-3-fluoro-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide
CID 139437081
1-[4-[4-(3,5-dimethyl-2-pyridinyl)piperazine-1-carbonyl]-3,5-difluorophenyl]piperidin-2-one
CID 71252543
1-[3-[(3R,4S)-3-(dimethylamino)-4-methylpyrrolidine-1-carbonyl]-4-fluorophenyl]pyrrolidin-2-one
CID 96513226
1-[1-(1-methylazetidin-3-yl)pyrazol-4-yl]pyrrolidin-2-one
CID 126945570
N-[1-(5-chloro-3-fluoro-2-pyridinyl)piperidin-3-yl]-N-methylcyclobutanecarboxamide
CID 166605987
N-[1-(5-chloro-3-fluoro-2-pyridinyl)piperidin-4-yl]-N-methylcyclobutanecarboxamide
CID 171335489
1-(3-fluoro-4-methoxyphenyl)piperidin-2-one
CID 142754617
1-[4-(4-acetyl-6-chloro-3-pyridinyl)-3-fluorophenyl]pyrrolidin-2-one
CID 142612200
2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide
CID 123383493
1-(6,7-dimethoxyquinazolin-4-yl)-N,N-dimethylazetidine-3-carboxamide
CID 171705302
ethyl 2-amino-5-(2-oxopiperidin-1-yl)pyridine-3-carboxylate
CID 53419442
N-cyclohexyl-N-[2-[1-[3-methoxy-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]piperidin-3-yl]ethyl]formamide;methanol
CID 143229497

Frequently Asked Questions

What is the IUPAC name of 1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide?
The IUPAC name of 1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide (CID 142414572) is 1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide.
What is the SMILES notation for 1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide?
The canonical SMILES for 1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide is CN(C)C(=O)C1CN(c2ncc(N3CCCC3=O)cc2F)C1.
What is the InChIKey of 1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide?
The InChIKey is YNWGCUFDUHCSNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN4O2/c1-18(2)15(22)10-8-19(9-10)14-12(16)6-11(7-17-14)20-5-3-4-13(20)21/h6-7,10H,3-5,8-9H2,1-2H3.
What are the key properties of 1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide?
1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide has a molecular weight of 306.34 g/mol, XLogP of 0.87, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide is sourced from PubChem (CID 142414572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).