N-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide

C17H22N2O2 — CID 62345794

IUPACN-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide
SMILESCCc1ccc(CNc2ccccc2CN(C)C(C)=O)o1
InChIInChI=1S/C17H22N2O2/c1-4-15-9-10-16(21-15)11-18-17-8-6-5-7-14(17)12-19(3)13(2)20/h5-10,18H,4,11-12H2,1-3H3
InChIKeyKZKONUANNHUKJY-UHFFFAOYSA-N
MW286.38 g/mol
LogP3.43
Rot. Bonds6

About N-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide

N-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide (PubChem CID 62345794) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide.

Molecular Properties

Compound NameN-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide
PubChem CID62345794
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC NameN-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide
SMILESCCc1ccc(CNc2ccccc2CN(C)C(C)=O)o1
InChIInChI=1S/C17H22N2O2/c1-4-15-9-10-16(21-15)11-18-17-8-6-5-7-14(17)12-19(3)13(2)20/h5-10,18H,4,11-12H2,1-3H3
InChIKeyKZKONUANNHUKJY-UHFFFAOYSA-N
XLogP3.43
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-[(5-bromothiophen-2-yl)methylamino]phenyl]methyl]-N-methylacetamide
CID 43692092
N-methyl-N-[[2-(1H-pyrrol-3-ylmethylamino)phenyl]methyl]acetamide
CID 66409381
[5-[[2-(diethylaminomethyl)anilino]methyl]furan-2-yl]methanol
CID 64580557
N-[[2-[(3-chlorophenyl)methylamino]phenyl]methyl]-N-methylacetamide
CID 43692106
N-[(5-ethylfuran-2-yl)methyl]-2-ethylsulfonylaniline
CID 62346709
N-methyl-N-[[2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)phenyl]methyl]acetamide
CID 166358700
N-methyl-N-[[2-(2-methylpentan-3-ylamino)phenyl]methyl]acetamide
CID 43782865
N-[[2-[(3-methoxy-2-methylpropyl)amino]phenyl]methyl]-N-methylacetamide
CID 116500960
N-[(5-ethylfuran-2-yl)methyl]-2-nitroaniline
CID 62344545
N-[[5-(difluoromethylsulfanylmethyl)furan-2-yl]methyl]-2-ethylaniline
CID 43764511
N-methyl-N-[[2-(propan-2-ylsulfonylamino)phenyl]methyl]acetamide
CID 62999124
N-[2-[[acetyl(methyl)amino]methyl]phenyl]-3-(ethylamino)propanamide
CID 62832902

Frequently Asked Questions

What is the IUPAC name of N-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide?
The IUPAC name of N-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide (CID 62345794) is N-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide.
What is the SMILES notation for N-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide?
The canonical SMILES for N-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide is CCc1ccc(CNc2ccccc2CN(C)C(C)=O)o1.
What is the InChIKey of N-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide?
The InChIKey is KZKONUANNHUKJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-4-15-9-10-16(21-15)11-18-17-8-6-5-7-14(17)12-19(3)13(2)20/h5-10,18H,4,11-12H2,1-3H3.
What are the key properties of N-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide?
N-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide has a molecular weight of 286.38 g/mol, XLogP of 3.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[(5-ethylfuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide is sourced from PubChem (CID 62345794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).