5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline

C15H24N2O — CID 115208156

IUPAC5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline
SMILESCCc1ccc(OC)c(N(C)CC2CCCN2)c1
InChIInChI=1S/C15H24N2O/c1-4-12-7-8-15(18-3)14(10-12)17(2)11-13-6-5-9-16-13/h7-8,10,13,16H,4-6,9,11H2,1-3H3
InChIKeyNTVIEJXOTRROHW-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.45
Rot. Bonds5

About 5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline

5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline (PubChem CID 115208156) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline.

Molecular Properties

Compound Name5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline
PubChem CID115208156
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline
SMILESCCc1ccc(OC)c(N(C)CC2CCCN2)c1
InChIInChI=1S/C15H24N2O/c1-4-12-7-8-15(18-3)14(10-12)17(2)11-13-6-5-9-16-13/h7-8,10,13,16H,4-6,9,11H2,1-3H3
InChIKeyNTVIEJXOTRROHW-UHFFFAOYSA-N
XLogP2.45
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-ethyl-4-methoxyphenyl)methyl]-N-methyl-1-pyrrolidin-2-ylmethanamine
CID 115208323
2,5-difluoro-4-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline
CID 115208207
3-ethyl-4-methoxy-N-methyl-N-(2-pyrrolidin-2-ylethyl)aniline
CID 115210219
2-[3-(5-ethyl-2-methoxyphenyl)propyl]pyrrolidine
CID 112518591
N-(bromomethyl)-5-ethyl-2-methoxy-N-methylaniline
CID 115261714
2-(3-fluoro-4-methoxyphenyl)-N-methyl-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 115208444
3,4-dimethoxy-N-methyl-N-(2-pyrrolidin-2-ylethyl)aniline
CID 115210196
N-[(4-methoxy-3-methylphenyl)methyl]-N-(pyrrolidin-2-ylmethyl)cyclopropanamine
CID 106599006
N'-(5-ethyl-2-methoxyphenyl)-N,N'-dimethylmethanediamine
CID 115226672
N-methyl-1-pyrrolidin-2-yl-N-[(3,4,5-trimethoxyphenyl)methyl]methanamine
CID 106602528
2-methoxy-4-[[propyl(pyrrolidin-2-ylmethyl)amino]methyl]benzonitrile
CID 106792877
5-chloro-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607639

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline?
The IUPAC name of 5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline (CID 115208156) is 5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline.
What is the SMILES notation for 5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline?
The canonical SMILES for 5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline is CCc1ccc(OC)c(N(C)CC2CCCN2)c1.
What is the InChIKey of 5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline?
The InChIKey is NTVIEJXOTRROHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-12-7-8-15(18-3)14(10-12)17(2)11-13-6-5-9-16-13/h7-8,10,13,16H,4-6,9,11H2,1-3H3.
What are the key properties of 5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline?
5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline has a molecular weight of 248.37 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)aniline is sourced from PubChem (CID 115208156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).