N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide

C20H23N3O4 — CID 18157076

IUPACN-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESCC1=C(C=C(C=C1)C(=O)NCCC(=O)N2CCCC2)NC(=O)C3=CC=CO3
InChIInChI=1S/C20H23N3O4/c1-14-6-7-15(13-16(14)22-20(26)17-5-4-12-27-17)19(25)21-9-8-18(24)23-10-2-3-11-23/h4-7,12-13H,2-3,8-11H2,1H3,(H,21,25)(H,22,26)
InChIKeyJHKCXBZMOCOGGL-UHFFFAOYSA-N
MW369.40 g/mol
LogP1.70
Rot. Bonds6

About N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide

N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide (PubChem CID 18157076) has the molecular formula C20H23N3O4 and a molecular weight of 369.40 g/mol. Its IUPAC name is N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide
PubChem CID18157076
Molecular FormulaC20H23N3O4
Molecular Weight369.40 g/mol
Exact Mass369.17
IUPAC NameN-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESCC1=C(C=C(C=C1)C(=O)NCCC(=O)N2CCCC2)NC(=O)C3=CC=CO3
InChIInChI=1S/C20H23N3O4/c1-14-6-7-15(13-16(14)22-20(26)17-5-4-12-27-17)19(25)21-9-8-18(24)23-10-2-3-11-23/h4-7,12-13H,2-3,8-11H2,1H3,(H,21,25)(H,22,26)
InChIKeyJHKCXBZMOCOGGL-UHFFFAOYSA-N
XLogP1.70
TPSA91.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity547

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.40
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Furalaxyl
CID 42504
Benzyl furanyl fentanyl
CID 42853213
N-(4-methylphenyl)furan-2-carboxamide
CID 785196
(E)-N-(2-methyl-4-(o-tolyldiazenyl)phenyl)furan-2-carboxamide
CID 2827423
N-[3-[[2-(diethylaminomethyl)phenyl]methylcarbamoyl]phenyl]furan-2-carboxamide
CID 152426927
N-(3-benzamidophenyl)furan-2-carboxamide
CID 825801
1-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 2955360
1-(furan-2-carbonyl)-N-(4-methylphenyl)piperidine-4-carboxamide
CID 6463949
Methyl 2-(furan-2-carbonylamino)benzoate
CID 310138
N-(2-methylphenyl)-2-furamide
CID 2246088
Aryl piperidine, 9g
CID 44236975
Aryl piperidine, 9i
CID 44236977

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide (CID 18157076) is N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide is CC1=C(C=C(C=C1)C(=O)NCCC(=O)N2CCCC2)NC(=O)C3=CC=CO3.
What is the InChIKey of N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is JHKCXBZMOCOGGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O4/c1-14-6-7-15(13-16(14)22-20(26)17-5-4-12-27-17)19(25)21-9-8-18(24)23-10-2-3-11-23/h4-7,12-13H,2-3,8-11H2,1H3,(H,21,25)(H,22,26).
What are the key properties of N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide?
N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 369.40 g/mol, XLogP of 1.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 18157076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).