N,2-diethyl-5-methylaniline;ethane

C13H23N — CID 143835073

IUPACN,2-diethyl-5-methylaniline;ethane
SMILESCC.CCNc1cc(C)ccc1CC
InChIInChI=1S/C11H17N.C2H6/c1-4-10-7-6-9(3)8-11(10)12-5-2;1-2/h6-8,12H,4-5H2,1-3H3;1-2H3
InChIKeyRDMWCRJYOZNPNJ-UHFFFAOYSA-N
MW193.33 g/mol
LogP4.02
Rot. Bonds3

About N,2-diethyl-5-methylaniline;ethane

N,2-diethyl-5-methylaniline;ethane (PubChem CID 143835073) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is N,2-diethyl-5-methylaniline;ethane.

Molecular Properties

Compound NameN,2-diethyl-5-methylaniline;ethane
PubChem CID143835073
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC NameN,2-diethyl-5-methylaniline;ethane
SMILESCC.CCNc1cc(C)ccc1CC
InChIInChI=1S/C11H17N.C2H6/c1-4-10-7-6-9(3)8-11(10)12-5-2;1-2/h6-8,12H,4-5H2,1-3H3;1-2H3
InChIKeyRDMWCRJYOZNPNJ-UHFFFAOYSA-N
XLogP4.02
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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ethane;2-ethyl-5-methylphenol
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2-[2-(ethylamino)-4-methylphenyl]propanoic acid
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N-ethyl-5-methyl-2-(2-methylpropylsulfonyl)aniline
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1-(dimethylamino)-3-(2-ethyl-5-methylphenyl)urea
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1-ethyl-2,4-dimethylbenzene;propane
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zinc;2-(ethylamino)-5-methylbenzenediazonium;trichloride
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Frequently Asked Questions

What is the IUPAC name of N,2-diethyl-5-methylaniline;ethane?
The IUPAC name of N,2-diethyl-5-methylaniline;ethane (CID 143835073) is N,2-diethyl-5-methylaniline;ethane.
What is the SMILES notation for N,2-diethyl-5-methylaniline;ethane?
The canonical SMILES for N,2-diethyl-5-methylaniline;ethane is CC.CCNc1cc(C)ccc1CC.
What is the InChIKey of N,2-diethyl-5-methylaniline;ethane?
The InChIKey is RDMWCRJYOZNPNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N.C2H6/c1-4-10-7-6-9(3)8-11(10)12-5-2;1-2/h6-8,12H,4-5H2,1-3H3;1-2H3.
What are the key properties of N,2-diethyl-5-methylaniline;ethane?
N,2-diethyl-5-methylaniline;ethane has a molecular weight of 193.33 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-diethyl-5-methylaniline;ethane is sourced from PubChem (CID 143835073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).