N,N-diethyl-4-methyl-1-benzofuran-6-amine

C13H17NO — CID 154131282

IUPACN,N-diethyl-4-methyl-1-benzofuran-6-amine
SMILESCCN(CC)c1cc(C)c2ccoc2c1
InChIInChI=1S/C13H17NO/c1-4-14(5-2)11-8-10(3)12-6-7-15-13(12)9-11/h6-9H,4-5H2,1-3H3
InChIKeyWFGDLOCZBWEJMV-UHFFFAOYSA-N
MW203.28 g/mol
LogP3.59
Rot. Bonds3

About N,N-diethyl-4-methyl-1-benzofuran-6-amine

N,N-diethyl-4-methyl-1-benzofuran-6-amine (PubChem CID 154131282) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is N,N-diethyl-4-methyl-1-benzofuran-6-amine.

Molecular Properties

Compound NameN,N-diethyl-4-methyl-1-benzofuran-6-amine
PubChem CID154131282
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC NameN,N-diethyl-4-methyl-1-benzofuran-6-amine
SMILESCCN(CC)c1cc(C)c2ccoc2c1
InChIInChI=1S/C13H17NO/c1-4-14(5-2)11-8-10(3)12-6-7-15-13(12)9-11/h6-9H,4-5H2,1-3H3
InChIKeyWFGDLOCZBWEJMV-UHFFFAOYSA-N
XLogP3.59
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-(diethylamino)-5-methylchromen-2-one
CID 164804520
6-fluoro-4-methyl-1-benzofuran
CID 66806743
4-(diethylamino)-2,6-dimethylphenol
CID 15751872
4-N,4-N-diethyl-2,6-dimethylbenzene-1,4-diamine
CID 14746073
7-(diethylamino)-4-methylchromen-2-one sulfate
CID 23622381
sodium;7-(diethylamino)-4-methylchromen-2-one;hydride;sulfuric acid
CID 174050797
4-methylfuro[3,2-e][1]benzofuran
CID 170151915
4-[[4-(diethylamino)phenyl]methyl]-N,N-diethyl-3-methylaniline
CID 86063425
1-N,1-N,4-N,4-N-tetraethylbenzene-1,4-diamine
CID 14438301
4-bis[4-(diethylamino)-2-methylphenyl]arsanyl-N,N-diethyl-3-methylaniline
CID 91746010
4-N,4-N-diethyl-1-N-[(3-methylfuran-2-yl)methyl]benzene-1,4-diamine
CID 115742858
7-[ethyl(methyl)amino]-4-methylchromen-2-one
CID 142927379

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-methyl-1-benzofuran-6-amine?
The IUPAC name of N,N-diethyl-4-methyl-1-benzofuran-6-amine (CID 154131282) is N,N-diethyl-4-methyl-1-benzofuran-6-amine.
What is the SMILES notation for N,N-diethyl-4-methyl-1-benzofuran-6-amine?
The canonical SMILES for N,N-diethyl-4-methyl-1-benzofuran-6-amine is CCN(CC)c1cc(C)c2ccoc2c1.
What is the InChIKey of N,N-diethyl-4-methyl-1-benzofuran-6-amine?
The InChIKey is WFGDLOCZBWEJMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-4-14(5-2)11-8-10(3)12-6-7-15-13(12)9-11/h6-9H,4-5H2,1-3H3.
What are the key properties of N,N-diethyl-4-methyl-1-benzofuran-6-amine?
N,N-diethyl-4-methyl-1-benzofuran-6-amine has a molecular weight of 203.28 g/mol, XLogP of 3.59, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-methyl-1-benzofuran-6-amine is sourced from PubChem (CID 154131282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).