N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline

C16H22N2O2 — CID 62430923

IUPACN-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline
SMILESCCNCc1ccc(CN(C)c2ccccc2OC)o1
InChIInChI=1S/C16H22N2O2/c1-4-17-11-13-9-10-14(20-13)12-18(2)15-7-5-6-8-16(15)19-3/h5-10,17H,4,11-12H2,1-3H3
InChIKeyZATRHGVUNMQICB-UHFFFAOYSA-N
MW274.36 g/mol
LogP3.03
Rot. Bonds7

About N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline

N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline (PubChem CID 62430923) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline.

Molecular Properties

Compound NameN-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline
PubChem CID62430923
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline
SMILESCCNCc1ccc(CN(C)c2ccccc2OC)o1
InChIInChI=1S/C16H22N2O2/c1-4-17-11-13-9-10-14(20-13)12-18(2)15-7-5-6-8-16(15)19-3/h5-10,17H,4,11-12H2,1-3H3
InChIKeyZATRHGVUNMQICB-UHFFFAOYSA-N
XLogP3.03
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-N'-(2-methoxyphenyl)-N'-methyl-2-methylidenepropane-1,3-diamine
CID 103070217
2-methoxy-N-methyl-N-[[5-methyl-4-(methylaminomethyl)furan-2-yl]methyl]aniline
CID 62430748
5-[(2-methoxy-N-methylanilino)methyl]furan-3-carboxylic acid
CID 62269776
N-[[5-(3-methoxy-2-pyridinyl)furan-2-yl]methyl]ethanamine
CID 114054079
5-(ethylaminomethyl)-N-(2-methoxyphenyl)furan-2-sulfonamide
CID 106045113
N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine
CID 62424825
N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,4-dimethylpentan-2-amine
CID 62461260
N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine
CID 62461555
2-methoxy-N-methyl-N-propylaniline
CID 23198488
methyl 5-[[N-(benzenesulfonyl)-2-methoxyanilino]methyl]furan-2-carboxylate
CID 2671799
5-[(2-methoxy-N-methylanilino)methyl]thiophene-2-carbohydrazide
CID 63585839
N-[[3-[(cyclopropylamino)methyl]-1,2-oxazol-5-yl]methyl]-2-methoxy-N-methylaniline
CID 62429145

Frequently Asked Questions

What is the IUPAC name of N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline?
The IUPAC name of N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline (CID 62430923) is N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline.
What is the SMILES notation for N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline?
The canonical SMILES for N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline is CCNCc1ccc(CN(C)c2ccccc2OC)o1.
What is the InChIKey of N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline?
The InChIKey is ZATRHGVUNMQICB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-4-17-11-13-9-10-14(20-13)12-18(2)15-7-5-6-8-16(15)19-3/h5-10,17H,4,11-12H2,1-3H3.
What are the key properties of N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline?
N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline has a molecular weight of 274.36 g/mol, XLogP of 3.03, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline is sourced from PubChem (CID 62430923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).