2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide

C23H26N2O3 — CID 59596821

IUPAC2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide
SMILESCNC(=O)CN(CCc1cccc(OCc2ccccc2)c1)Cc1ccco1
InChIInChI=1S/C23H26N2O3/c1-24-23(26)17-25(16-22-11-6-14-27-22)13-12-19-9-5-10-21(15-19)28-18-20-7-3-2-4-8-20/h2-11,14-15H,12-13,16-18H2,1H3,(H,24,26)
InChIKeyXPXAHFDXEVRUDF-UHFFFAOYSA-N
MW378.47 g/mol
LogP3.65
Rot. Bonds10

About 2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide

2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide (PubChem CID 59596821) has the molecular formula C23H26N2O3 and a molecular weight of 378.47 g/mol. Its IUPAC name is 2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide.

Molecular Properties

Compound Name2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide
PubChem CID59596821
Molecular FormulaC23H26N2O3
Molecular Weight378.47 g/mol
Exact Mass378.19
IUPAC Name2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide
SMILESCNC(=O)CN(CCc1cccc(OCc2ccccc2)c1)Cc1ccco1
InChIInChI=1S/C23H26N2O3/c1-24-23(26)17-25(16-22-11-6-14-27-22)13-12-19-9-5-10-21(15-19)28-18-20-7-3-2-4-8-20/h2-11,14-15H,12-13,16-18H2,1H3,(H,24,26)
InChIKeyXPXAHFDXEVRUDF-UHFFFAOYSA-N
XLogP3.65
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.47
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride
CID 66590485
N-[2-(dimethylamino)ethyl]-2-[2-[3-[(3-fluorophenyl)methoxy]phenyl]ethyl-(furan-2-ylmethyl)amino]acetamide;dihydrochloride
CID 66591504
2-[2-[3-[(3-fluorophenyl)methoxy]phenyl]ethyl-(furan-2-ylmethyl)amino]-N-(2-methoxyethyl)acetamide;hydrochloride
CID 66591030
2-[2-[3-[2-[(dimethylamino)methyl]phenyl]phenyl]ethyl-(furan-2-ylmethyl)amino]-N-methylacetamide;hydrochloride
CID 66591426
2-[2-[3-[(3-fluorophenyl)methoxy]phenyl]ethyl-(furan-2-ylmethyl)amino]-N-(1H-pyrazol-5-yl)acetamide
CID 66591114
2-[bis(furan-2-ylmethyl)amino]-N-methylacetamide
CID 27118866
3-bromo-N-(furan-2-ylmethyl)-N-[(3-phenylmethoxyphenyl)methyl]benzamide
CID 42706159
N-(furan-2-ylmethyl)-N-[(3-phenylmethoxyphenyl)methyl]cyclohexanecarboxamide
CID 42706156
N-(furan-2-ylmethyl)-1-(3-phenylmethoxyphenyl)methanamine;hydrochloride
CID 2996544
2-[2-[3-[(2-chlorophenyl)methoxy]phenyl]ethyl-(furan-2-ylmethyl)amino]propanamide
CID 91450426
2-[bis(furan-2-ylmethyl)amino]-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide
CID 24574981
2-[(3-ethoxyphenyl)methyl-(2-phenylethyl)amino]acetic acid
CID 39453886

Frequently Asked Questions

What is the IUPAC name of 2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide?
The IUPAC name of 2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide (CID 59596821) is 2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide.
What is the SMILES notation for 2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide?
The canonical SMILES for 2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide is CNC(=O)CN(CCc1cccc(OCc2ccccc2)c1)Cc1ccco1.
What is the InChIKey of 2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide?
The InChIKey is XPXAHFDXEVRUDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O3/c1-24-23(26)17-25(16-22-11-6-14-27-22)13-12-19-9-5-10-21(15-19)28-18-20-7-3-2-4-8-20/h2-11,14-15H,12-13,16-18H2,1H3,(H,24,26).
What are the key properties of 2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide?
2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide has a molecular weight of 378.47 g/mol, XLogP of 3.65, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide is sourced from PubChem (CID 59596821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).