N-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline

C15H25NO — CID 43738989

IUPACN-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline
SMILESCCC(CC)CNc1ccc(C)c(OC)c1C
InChIInChI=1S/C15H25NO/c1-6-13(7-2)10-16-14-9-8-11(3)15(17-5)12(14)4/h8-9,13,16H,6-7,10H2,1-5H3
InChIKeyLDYINAHHDPVOJK-UHFFFAOYSA-N
MW235.37 g/mol
LogP4.16
Rot. Bonds6

About N-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline

N-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline (PubChem CID 43738989) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is N-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline.

Molecular Properties

Compound NameN-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline
PubChem CID43738989
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC NameN-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline
SMILESCCC(CC)CNc1ccc(C)c(OC)c1C
InChIInChI=1S/C15H25NO/c1-6-13(7-2)10-16-14-9-8-11(3)15(17-5)12(14)4/h8-9,13,16H,6-7,10H2,1-5H3
InChIKeyLDYINAHHDPVOJK-UHFFFAOYSA-N
XLogP4.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylbutyl)-4,5-dimethoxy-2-methylaniline
CID 43716743
3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-2,4-dimethylaniline
CID 112752565
N-(2-ethylbutyl)-2-methylaniline
CID 29290197
N-[(2,6-difluorophenyl)methyl]-3-methoxy-2,4-dimethylaniline
CID 43738958
methyl 3-(2-ethylbutylamino)-2-methylbenzoate
CID 43714418
2-ethyl-N'-(2-methoxy-3,5-dimethylphenyl)propane-1,3-diamine
CID 115251223
5-chloro-N-(2-ethylbutyl)-2-methoxyaniline
CID 29289314
N-(2-ethylbutyl)-4-fluoro-2-methoxyaniline
CID 60961963
N-(3-ethoxycyclobutyl)-3-methoxy-2,4-dimethylaniline
CID 112561854
N-[(4-bromo-3-methylphenyl)methyl]-3-methoxy-2,4-dimethylaniline
CID 66473407
N-ethyl-3,4-dimethoxy-2-methylaniline
CID 143026741
N-(3-methoxy-2,4-dimethylphenyl)formamide
CID 64992554

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline?
The IUPAC name of N-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline (CID 43738989) is N-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline.
What is the SMILES notation for N-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline?
The canonical SMILES for N-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline is CCC(CC)CNc1ccc(C)c(OC)c1C.
What is the InChIKey of N-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline?
The InChIKey is LDYINAHHDPVOJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-6-13(7-2)10-16-14-9-8-11(3)15(17-5)12(14)4/h8-9,13,16H,6-7,10H2,1-5H3.
What are the key properties of N-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline?
N-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline has a molecular weight of 235.37 g/mol, XLogP of 4.16, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylbutyl)-3-methoxy-2,4-dimethylaniline is sourced from PubChem (CID 43738989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).