2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide

C23H25NO3 — CID 46456653

IUPAC2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide
SMILESCc1oc(C)c(C(=O)NCc2ccccc2COCc2ccccc2)c1C
InChIInChI=1S/C23H25NO3/c1-16-17(2)27-18(3)22(16)23(25)24-13-20-11-7-8-12-21(20)15-26-14-19-9-5-4-6-10-19/h4-12H,13-15H2,1-3H3,(H,24,25)
InChIKeyKGOJBLNCAKMIDR-UHFFFAOYSA-N
MW363.46 g/mol
LogP4.85
Rot. Bonds7

About 2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide

2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide (PubChem CID 46456653) has the molecular formula C23H25NO3 and a molecular weight of 363.46 g/mol. Its IUPAC name is 2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide.

Molecular Properties

Compound Name2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide
PubChem CID46456653
Molecular FormulaC23H25NO3
Molecular Weight363.46 g/mol
Exact Mass363.18
IUPAC Name2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide
SMILESCc1oc(C)c(C(=O)NCc2ccccc2COCc2ccccc2)c1C
InChIInChI=1S/C23H25NO3/c1-16-17(2)27-18(3)22(16)23(25)24-13-20-11-7-8-12-21(20)15-26-14-19-9-5-4-6-10-19/h4-12H,13-15H2,1-3H3,(H,24,25)
InChIKeyKGOJBLNCAKMIDR-UHFFFAOYSA-N
XLogP4.85
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-2-carboxamide
CID 46465244
2,4,5-trimethyl-N-[[2-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]furan-3-carboxamide
CID 46477048
N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-2,4,5-trimethylfuran-3-carboxamide
CID 32889747
(2R)-2-amino-N-[[2-(phenylmethoxymethyl)phenyl]methyl]propanamide
CID 119286428
methyl 3-[[2-(phenylmethoxymethyl)phenyl]methylcarbamoyl]benzoate
CID 55766169
2-(4-bromophenyl)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide
CID 55694421
N-[[2-(phenylmethoxymethyl)phenyl]methyl]-2-sulfamoylpropanamide
CID 154868821
methyl (2R)-2-methyl-4-oxo-4-[[2-(phenylmethoxymethyl)phenyl]methylamino]butanoate
CID 97019366
1-(2-hydroxyethyl)-3-[[2-(phenylmethoxymethyl)phenyl]methyl]urea
CID 110894223
3-amino-N-[[2-(phenylmethoxymethyl)phenyl]methyl]propanamide;hydrochloride
CID 119286417
2,5-dichloro-N-[[2-(phenylmethoxymethyl)phenyl]methyl]thiophene-3-carboxamide
CID 55694446
N-[[2-(phenylmethoxymethyl)phenyl]methyl]-1,3-benzodioxole-4-carboxamide
CID 55835583

Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide?
The IUPAC name of 2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide (CID 46456653) is 2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide.
What is the SMILES notation for 2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide?
The canonical SMILES for 2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide is Cc1oc(C)c(C(=O)NCc2ccccc2COCc2ccccc2)c1C.
What is the InChIKey of 2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide?
The InChIKey is KGOJBLNCAKMIDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO3/c1-16-17(2)27-18(3)22(16)23(25)24-13-20-11-7-8-12-21(20)15-26-14-19-9-5-4-6-10-19/h4-12H,13-15H2,1-3H3,(H,24,25).
What are the key properties of 2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide?
2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide has a molecular weight of 363.46 g/mol, XLogP of 4.85, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide is sourced from PubChem (CID 46456653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).