N-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide

C21H19N3O3 — CID 24670276

IUPACN-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(C(=O)N2CCCC2c2ccncc2)cc1)c1ccco1
InChIInChI=1S/C21H19N3O3/c25-20(19-4-2-14-27-19)23-17-7-5-16(6-8-17)21(26)24-13-1-3-18(24)15-9-11-22-12-10-15/h2,4-12,14,18H,1,3,13H2,(H,23,25)
InChIKeyOKWPDOPCPQOQIB-UHFFFAOYSA-N
MW361.40 g/mol
LogP3.90
Rot. Bonds4

About N-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide

N-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide (PubChem CID 24670276) has the molecular formula C21H19N3O3 and a molecular weight of 361.40 g/mol. Its IUPAC name is N-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide
PubChem CID24670276
Molecular FormulaC21H19N3O3
Molecular Weight361.40 g/mol
Exact Mass361.14
IUPAC NameN-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(C(=O)N2CCCC2c2ccncc2)cc1)c1ccco1
InChIInChI=1S/C21H19N3O3/c25-20(19-4-2-14-27-19)23-17-7-5-16(6-8-17)21(26)24-13-1-3-18(24)15-9-11-22-12-10-15/h2,4-12,14,18H,1,3,13H2,(H,23,25)
InChIKeyOKWPDOPCPQOQIB-UHFFFAOYSA-N
XLogP3.90
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.40
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-methyl-5-[2-(4-methylphenyl)pyrrolidine-1-carbonyl]phenyl]furan-2-carboxamide
CID 55550875
(4-ethylphenyl)-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
CID 42939220
N-[4-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide
CID 9035306
furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
CID 24631497
[2-(4-bromophenyl)pyrrolidin-1-yl]-(furan-2-yl)methanone
CID 47313418
N-[5-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidine-1-carbonyl]-2-methylphenyl]furan-2-carboxamide
CID 41138513
N-[4-methyl-5-[2-(4-methylphenyl)pyrrolidine-1-carbonyl]thiophen-2-yl]furan-2-carboxamide
CID 55552482
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
[3-(methoxymethyl)phenyl]-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
CID 86920457
[4-[(2S)-2-pyridin-4-ylazepane-1-carbonyl]phenyl]methylurea
CID 97012051
N-[4-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine-1-carbonyl]phenyl]furan-2-carboxamide
CID 86935480
(3-bromophenyl)-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
CID 46632632

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide (CID 24670276) is N-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide is O=C(Nc1ccc(C(=O)N2CCCC2c2ccncc2)cc1)c1ccco1.
What is the InChIKey of N-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide?
The InChIKey is OKWPDOPCPQOQIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O3/c25-20(19-4-2-14-27-19)23-17-7-5-16(6-8-17)21(26)24-13-1-3-18(24)15-9-11-22-12-10-15/h2,4-12,14,18H,1,3,13H2,(H,23,25).
What are the key properties of N-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide?
N-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide has a molecular weight of 361.40 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 24670276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).