(2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide

C18H19N3O4 — CID 51980891

IUPAC(2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)[C@H]2CCCN2C(=O)c2ccco2)c1
InChIInChI=1S/C18H19N3O4/c1-12(22)19-13-5-2-6-14(11-13)20-17(23)15-7-3-9-21(15)18(24)16-8-4-10-25-16/h2,4-6,8,10-11,15H,3,7,9H2,1H3,(H,19,22)(H,20,23)/t15-/m1/s1
InChIKeyCRFUEEILPVFJFZ-OAHLLOKOSA-N
MW341.37 g/mol
LogP2.48
Rot. Bonds4

About (2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide

(2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide (PubChem CID 51980891) has the molecular formula C18H19N3O4 and a molecular weight of 341.37 g/mol. Its IUPAC name is (2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide
PubChem CID51980891
Molecular FormulaC18H19N3O4
Molecular Weight341.37 g/mol
Exact Mass341.14
IUPAC Name(2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)[C@H]2CCCN2C(=O)c2ccco2)c1
InChIInChI=1S/C18H19N3O4/c1-12(22)19-13-5-2-6-14(11-13)20-17(23)15-7-3-9-21(15)18(24)16-8-4-10-25-16/h2,4-6,8,10-11,15H,3,7,9H2,1H3,(H,19,22)(H,20,23)/t15-/m1/s1
InChIKeyCRFUEEILPVFJFZ-OAHLLOKOSA-N
XLogP2.48
TPSA91.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(furan-2-carbonyl)-N-(3-iodophenyl)pyrrolidine-2-carboxamide
CID 71902260
(2R)-N-(3-carbamoylphenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide
CID 32821866
N-(3-carbamoylphenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide
CID 24659016
methyl 2-[3-[[(2R)-1-(furan-2-carbonyl)piperidine-2-carbonyl]amino]phenyl]acetate
CID 99589299
1-(furan-2-carbonyl)-N-(4-methoxyphenyl)pyrrolidine-2-carboxamide
CID 50875716
(2S)-1-(furan-2-carbonyl)-N-(2-methyl-4-pyridinyl)piperidine-2-carboxamide
CID 96526953
(2S)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide
CID 55940765
ethyl 3-[[1-(furan-2-carbonyl)piperidine-2-carbonyl]amino]benzoate
CID 60551969
1-(furan-2-carbonyl)-N-[4-(4-methylphenoxy)phenyl]pyrrolidine-2-carboxamide
CID 24658906
N-[4-bromo-3-(trifluoromethyl)phenyl]-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide
CID 24658893
2-[3-[[1-(furan-2-carbonyl)piperidine-2-carbonyl]amino]phenoxy]acetic acid
CID 119224814
1-(furan-2-carbonyl)-N-[4-(4-methylpiperidin-1-yl)phenyl]pyrrolidine-2-carboxamide
CID 102603994

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide (CID 51980891) is (2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide is CC(=O)Nc1cccc(NC(=O)[C@H]2CCCN2C(=O)c2ccco2)c1.
What is the InChIKey of (2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide?
The InChIKey is CRFUEEILPVFJFZ-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H19N3O4/c1-12(22)19-13-5-2-6-14(11-13)20-17(23)15-7-3-9-21(15)18(24)16-8-4-10-25-16/h2,4-6,8,10-11,15H,3,7,9H2,1H3,(H,19,22)(H,20,23)/t15-/m1/s1.
What are the key properties of (2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide?
(2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide has a molecular weight of 341.37 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-acetamidophenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 51980891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).