N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide

C16H19NO4 — CID 31288728

IUPACN-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide
SMILESCOc1cc(C(=O)N(C)Cc2ccco2)cc(OC)c1C
InChIInChI=1S/C16H19NO4/c1-11-14(19-3)8-12(9-15(11)20-4)16(18)17(2)10-13-6-5-7-21-13/h5-9H,10H2,1-4H3
InChIKeyFDZZZXXSHZXVGQ-UHFFFAOYSA-N
MW289.33 g/mol
LogP2.88
Rot. Bonds5

About N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide

N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide (PubChem CID 31288728) has the molecular formula C16H19NO4 and a molecular weight of 289.33 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide
PubChem CID31288728
Molecular FormulaC16H19NO4
Molecular Weight289.33 g/mol
Exact Mass289.13
IUPAC NameN-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide
SMILESCOc1cc(C(=O)N(C)Cc2ccco2)cc(OC)c1C
InChIInChI=1S/C16H19NO4/c1-11-14(19-3)8-12(9-15(11)20-4)16(18)17(2)10-13-6-5-7-21-13/h5-9H,10H2,1-4H3
InChIKeyFDZZZXXSHZXVGQ-UHFFFAOYSA-N
XLogP2.88
TPSA51.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-N-(furan-2-ylmethyl)-4,5-dimethoxy-N-methylbenzamide
CID 27719528
2-amino-N-(furan-2-ylmethyl)-4,5-dimethoxy-N-methylbenzamide
CID 43526528
3-chloro-N-(furan-2-ylmethyl)-5-methoxy-N-methyl-4-(2-methylpropoxy)benzamide
CID 55334280
N-(furan-2-ylmethyl)-N-methyl-4-propan-2-yloxy-1-benzofuran-6-carboxamide
CID 71688772
3-amino-N-(furan-2-ylmethyl)-5-iodo-N-methylbenzamide
CID 112750794
methyl N-(furan-2-ylmethyl)-N-methylcarbamate
CID 2755161
2-amino-N-(furan-2-ylmethyl)-5-methoxy-N-methylbenzamide
CID 54878485
N-(furan-2-ylmethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide
CID 103763376
N-(furan-2-ylmethyl)-N-methyl-4-(phenoxymethyl)benzamide
CID 112761039
5-bromo-N-(furan-2-ylmethyl)-N-methylpyridine-3-carboxamide
CID 60629759
N-(furan-2-ylmethyl)-N,4-dimethyl-3-pyrrol-1-ylbenzamide
CID 18135649
2-amino-N-(furan-2-ylmethyl)-N,5-dimethylbenzamide
CID 62072448

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide?
The IUPAC name of N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide (CID 31288728) is N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide?
The canonical SMILES for N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide is COc1cc(C(=O)N(C)Cc2ccco2)cc(OC)c1C.
What is the InChIKey of N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide?
The InChIKey is FDZZZXXSHZXVGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO4/c1-11-14(19-3)8-12(9-15(11)20-4)16(18)17(2)10-13-6-5-7-21-13/h5-9H,10H2,1-4H3.
What are the key properties of N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide?
N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide has a molecular weight of 289.33 g/mol, XLogP of 2.88, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide is sourced from PubChem (CID 31288728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).