N-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline

C14H23NO2 — CID 102849074

IUPACN-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline
SMILESCOCCc1ccccc1NC(C)CCOC
InChIInChI=1S/C14H23NO2/c1-12(8-10-16-2)15-14-7-5-4-6-13(14)9-11-17-3/h4-7,12,15H,8-11H2,1-3H3
InChIKeyUMICLOSSANMEQA-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.71
Rot. Bonds8

About N-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline

N-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline (PubChem CID 102849074) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is N-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline.

Molecular Properties

Compound NameN-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline
PubChem CID102849074
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC NameN-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline
SMILESCOCCc1ccccc1NC(C)CCOC
InChIInChI=1S/C14H23NO2/c1-12(8-10-16-2)15-14-7-5-4-6-13(14)9-11-17-3/h4-7,12,15H,8-11H2,1-3H3
InChIKeyUMICLOSSANMEQA-UHFFFAOYSA-N
XLogP2.71
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxyethyl)-N-propan-2-ylaniline
CID 102847364
2-(2-methoxyethyl)-N-(3-methylpentan-2-yl)aniline
CID 102848997
N-but-3-en-2-yl-2-(2-methoxyethyl)aniline
CID 107908300
N-(4-methoxybutan-2-yl)-2-methylpyridin-3-amine
CID 79042219
methyl 3-[2-(2-methoxyethyl)anilino]-2-methylbutanoate
CID 102905002
4-[1-[2-(2-methoxyethyl)anilino]ethyl]phenol
CID 102903882
N-(2,2-dimethoxyethyl)-2-(2-methoxyethyl)aniline
CID 102903791
N-[2-(2-methoxyethyl)phenyl]-2-methylpropanamide
CID 18982774
3-methoxy-2-[2-(2-methoxyethyl)anilino]propanoic acid
CID 103268791
2-fluoro-N-(4-methoxybutan-2-yl)-3-methylaniline
CID 115923356
2-(2-methoxyethyl)-N-pent-1-yn-3-ylaniline
CID 102904964
N-[1-(5-bromofuran-2-yl)ethyl]-2-(2-methoxyethyl)aniline
CID 102903779

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline?
The IUPAC name of N-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline (CID 102849074) is N-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline.
What is the SMILES notation for N-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline?
The canonical SMILES for N-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline is COCCc1ccccc1NC(C)CCOC.
What is the InChIKey of N-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline?
The InChIKey is UMICLOSSANMEQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-12(8-10-16-2)15-14-7-5-4-6-13(14)9-11-17-3/h4-7,12,15H,8-11H2,1-3H3.
What are the key properties of N-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline?
N-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline has a molecular weight of 237.34 g/mol, XLogP of 2.71, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxybutan-2-yl)-2-(2-methoxyethyl)aniline is sourced from PubChem (CID 102849074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).