N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide

C18H18N2O2 — CID 18135649

IUPACN-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide
SMILESCc1ccc(C(=O)N(C)Cc2ccco2)cc1-n1cccc1
InChIInChI=1S/C18H18N2O2/c1-14-7-8-15(12-17(14)20-9-3-4-10-20)18(21)19(2)13-16-6-5-11-22-16/h3-12H,13H2,1-2H3
InChIKeyYZDHUIDRRNHIRY-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.65
Rot. Bonds4

About N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide

N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide (PubChem CID 18135649) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide
PubChem CID18135649
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC NameN-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide
SMILESCc1ccc(C(=O)N(C)Cc2ccco2)cc1-n1cccc1
InChIInChI=1S/C18H18N2O2/c1-14-7-8-15(12-17(14)20-9-3-4-10-20)18(21)19(2)13-16-6-5-11-22-16/h3-12H,13H2,1-2H3
InChIKeyYZDHUIDRRNHIRY-UHFFFAOYSA-N
XLogP3.65
TPSA38.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide 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

N,4-dimethyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-3-pyrrol-1-ylbenzamide
CID 24596146
N-(furan-2-ylmethyl)-N-methyl-9-oxofluorene-2-carboxamide
CID 24615704
N-(furan-2-ylmethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide
CID 103763376
N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide
CID 31288728
3-(benzylsulfamoyl)-N-(furan-2-ylmethyl)-N,4-dimethylbenzamide
CID 24542584
3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide
CID 4824191
2-(2,5-dimethylphenyl)-N,N-bis(furan-2-ylmethyl)-1,3-dioxoisoindole-5-carboxamide
CID 112767046
(6aS)-N-(furan-2-ylmethyl)-N,5-dimethyl-6-oxo-7,8,9,10-tetrahydro-6aH-pyrido[1,2-a]quinoxaline-3-carboxamide
CID 92726318
(2R)-N-(furan-2-ylmethyl)-N,2-dimethyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide
CID 27739678
N-(furan-2-ylmethyl)-N,2-dimethyl-5-methylsulfonylbenzamide
CID 27739527
4-methyl-3-pyrrol-1-ylbenzamide
CID 91674702
5-bromo-N-(furan-2-ylmethyl)-N-methylpyridine-3-carboxamide
CID 60629759

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide?
The IUPAC name of N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide (CID 18135649) is N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide is Cc1ccc(C(=O)N(C)Cc2ccco2)cc1-n1cccc1.
What is the InChIKey of N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide?
The InChIKey is YZDHUIDRRNHIRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-14-7-8-15(12-17(14)20-9-3-4-10-20)18(21)19(2)13-16-6-5-11-22-16/h3-12H,13H2,1-2H3.
What are the key properties of N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide?
N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide has a molecular weight of 294.35 g/mol, XLogP of 3.65, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide is sourced from PubChem (CID 18135649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).