N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide

C16H17N3O3 — CID 71942102

IUPACN-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide
SMILESO=C(NCC(=O)N1CCCC1c1ccncc1)c1ccoc1
InChIInChI=1S/C16H17N3O3/c20-15(10-18-16(21)13-5-9-22-11-13)19-8-1-2-14(19)12-3-6-17-7-4-12/h3-7,9,11,14H,1-2,8,10H2,(H,18,21)
InChIKeyZURDOLQTHKXGMT-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.77
Rot. Bonds4

About N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide

N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide (PubChem CID 71942102) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide
PubChem CID71942102
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC NameN-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide
SMILESO=C(NCC(=O)N1CCCC1c1ccncc1)c1ccoc1
InChIInChI=1S/C16H17N3O3/c20-15(10-18-16(21)13-5-9-22-11-13)19-8-1-2-14(19)12-3-6-17-7-4-12/h3-7,9,11,14H,1-2,8,10H2,(H,18,21)
InChIKeyZURDOLQTHKXGMT-UHFFFAOYSA-N
XLogP1.77
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
CID 24631497
2,2-dimethyl-N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]propanamide
CID 86921275
N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazecan-1-yl)ethyl]furan-3-carboxamide
CID 110200186
[(2R)-1-[2-(pyridine-4-carbonylamino)acetyl]pyrrolidin-2-yl]boronic acid
CID 71655265
4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanoic acid
CID 43578440
3,5-dimethyl-N-[2-oxo-2-[(2R)-2-phenylpyrrolidin-1-yl]ethyl]benzamide
CID 41264652
3,5-dimethoxy-N-[2-oxo-2-[(2R)-2-phenylpyrrolidin-1-yl]ethyl]benzamide
CID 41264676
3,5-dimethoxy-N-[2-oxo-2-[(2S)-2-phenylpyrrolidin-1-yl]ethyl]benzamide
CID 41264677
N-[2-oxo-2-[(4R)-4-phenylazepan-1-yl]ethyl]furan-3-carboxamide
CID 95180599
1-[3-(furan-3-carbonylamino)propanoyl]pyrrolidine-2-carboxylic acid
CID 43355669
5-bromo-N-[2-[2-(4-bromophenyl)pyrrolidin-1-yl]-2-oxoethyl]furan-2-carboxamide
CID 55955381
4-(difluoromethoxy)-N-[2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl]benzamide
CID 25479486

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide?
The IUPAC name of N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide (CID 71942102) is N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide.
What is the SMILES notation for N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide?
The canonical SMILES for N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide is O=C(NCC(=O)N1CCCC1c1ccncc1)c1ccoc1.
What is the InChIKey of N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide?
The InChIKey is ZURDOLQTHKXGMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c20-15(10-18-16(21)13-5-9-22-11-13)19-8-1-2-14(19)12-3-6-17-7-4-12/h3-7,9,11,14H,1-2,8,10H2,(H,18,21).
What are the key properties of N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide?
N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide has a molecular weight of 299.33 g/mol, XLogP of 1.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-(2-pyridin-4-ylpyrrolidin-1-yl)ethyl]furan-3-carboxamide is sourced from PubChem (CID 71942102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).