2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline

C15H25NO — CID 43147091

IUPAC2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline
SMILESCCc1ccccc1NC(C)CC(C)(C)OC
InChIInChI=1S/C15H25NO/c1-6-13-9-7-8-10-14(13)16-12(2)11-15(3,4)17-5/h7-10,12,16H,6,11H2,1-5H3
InChIKeyRFXOKGORJPNNSH-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.86
Rot. Bonds6

About 2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline

2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline (PubChem CID 43147091) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is 2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline.

Molecular Properties

Compound Name2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline
PubChem CID43147091
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline
SMILESCCc1ccccc1NC(C)CC(C)(C)OC
InChIInChI=1S/C15H25NO/c1-6-13-9-7-8-10-14(13)16-12(2)11-15(3,4)17-5/h7-10,12,16H,6,11H2,1-5H3
InChIKeyRFXOKGORJPNNSH-UHFFFAOYSA-N
XLogP3.86
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 ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-[(4-methoxy-4-methylpentan-2-yl)amino]benzoate
CID 43321970
N-(4-methoxy-4-methylpentan-2-yl)-2-(trifluoromethylsulfanyl)aniline
CID 43676612
1-N,1-N'-bis(2-ethylphenyl)ethane-1,1-diamine
CID 129291272
N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine
CID 43146991
4-methoxy-N-[[2-(methoxymethyl)phenyl]methyl]-4-methylpentan-2-amine
CID 54861814
4-methoxy-4-methyl-N-[2-(2-methylphenyl)ethyl]pentan-2-amine
CID 79763034
4-methoxy-3-[(4-methoxy-4-methylpentan-2-yl)amino]benzoic acid
CID 63742469
4-methoxy-4-methyl-N-[(1S)-1-phenylethyl]pentan-2-amine
CID 81351575
4-[(4-methoxy-4-methylpentan-2-yl)amino]phenol
CID 43742567
3-ethyl-N-(1-methoxypropan-2-yl)-2-methylaniline
CID 90001609
ethyl 4-methoxy-4-methyl-2-(2-methylanilino)pentanoate
CID 106675948
N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 60943379

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline?
The IUPAC name of 2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline (CID 43147091) is 2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline.
What is the SMILES notation for 2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline?
The canonical SMILES for 2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline is CCc1ccccc1NC(C)CC(C)(C)OC.
What is the InChIKey of 2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline?
The InChIKey is RFXOKGORJPNNSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-6-13-9-7-8-10-14(13)16-12(2)11-15(3,4)17-5/h7-10,12,16H,6,11H2,1-5H3.
What are the key properties of 2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline?
2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline has a molecular weight of 235.37 g/mol, XLogP of 3.86, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline is sourced from PubChem (CID 43147091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).