1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide

C23H22N2O4 — CID 24658906

IUPAC1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide
SMILESCc1ccc(Oc2ccc(NC(=O)C3CCCN3C(=O)c3ccco3)cc2)cc1
InChIInChI=1S/C23H22N2O4/c1-16-6-10-18(11-7-16)29-19-12-8-17(9-13-19)24-22(26)20-4-2-14-25(20)23(27)21-5-3-15-28-21/h3,5-13,15,20H,2,4,14H2,1H3,(H,24,26)
InChIKeyAIAUIJRCJHTJMV-UHFFFAOYSA-N
MW390.44 g/mol
LogP4.62
Rot. Bonds5

About 1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide

1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide (PubChem CID 24658906) has the molecular formula C23H22N2O4 and a molecular weight of 390.44 g/mol. Its IUPAC name is 1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide
PubChem CID24658906
Molecular FormulaC23H22N2O4
Molecular Weight390.44 g/mol
Exact Mass390.16
IUPAC Name1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide
SMILESCc1ccc(Oc2ccc(NC(=O)C3CCCN3C(=O)c3ccco3)cc2)cc1
InChIInChI=1S/C23H22N2O4/c1-16-6-10-18(11-7-16)29-19-12-8-17(9-13-19)24-22(26)20-4-2-14-25(20)23(27)21-5-3-15-28-21/h3,5-13,15,20H,2,4,14H2,1H3,(H,24,26)
InChIKeyAIAUIJRCJHTJMV-UHFFFAOYSA-N
XLogP4.62
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.44
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(furan-2-carbonyl)-N-(4-methoxyphenyl)pyrrolidine-2-carboxamide
CID 50875716
1-(furan-2-carbonyl)-N-[4-(2-methoxyphenoxy)phenyl]pyrrolidine-2-carboxamide
CID 42923415
1-(furan-2-carbonyl)-N-[4-(2-methoxyethoxy)phenyl]pyrrolidine-2-carboxamide
CID 55675227
(2S)-1-(furan-2-carbonyl)-N-[4-(trifluoromethoxy)phenyl]pyrrolidine-2-carboxamide
CID 46420968
1-(furan-2-carbonyl)-N-[4-(4-methylpiperidin-1-yl)phenyl]pyrrolidine-2-carboxamide
CID 102603994
butyl 4-[[1-(furan-2-carbonyl)pyrrolidine-2-carbonyl]amino]benzoate
CID 24658807
(2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide
CID 51980891
N-[4-[ethyl(propan-2-yl)amino]phenyl]-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide
CID 51191794
(2S)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide
CID 55940765
2-[4-[[1-(furan-2-carbonyl)piperidine-2-carbonyl]amino]phenyl]-2-methylpropanoic acid
CID 119254206
1-(furan-2-carbonyl)-N-(3-iodophenyl)pyrrolidine-2-carboxamide
CID 71902260
(2S)-1-(furan-2-carbonyl)-N-(2-methyl-4-pyridinyl)piperidine-2-carboxamide
CID 96526953

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide?
The IUPAC name of 1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide (CID 24658906) is 1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide is Cc1ccc(Oc2ccc(NC(=O)C3CCCN3C(=O)c3ccco3)cc2)cc1.
What is the InChIKey of 1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide?
The InChIKey is AIAUIJRCJHTJMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O4/c1-16-6-10-18(11-7-16)29-19-12-8-17(9-13-19)24-22(26)20-4-2-14-25(20)23(27)21-5-3-15-28-21/h3,5-13,15,20H,2,4,14H2,1H3,(H,24,26).
What are the key properties of 1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide?
1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide has a molecular weight of 390.44 g/mol, XLogP of 4.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 24658906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).