2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine

C14H23NO2 — CID 116719987

IUPAC2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine
SMILESCNC(c1cccc(OC)c1)C(OC)C(C)C
InChIInChI=1S/C14H23NO2/c1-10(2)14(17-5)13(15-3)11-7-6-8-12(9-11)16-4/h6-10,13-15H,1-5H3
InChIKeyGGPJRKBLRIENCU-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.63
Rot. Bonds6

About 2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine

2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine (PubChem CID 116719987) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine.

Molecular Properties

Compound Name2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine
PubChem CID116719987
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine
SMILESCNC(c1cccc(OC)c1)C(OC)C(C)C
InChIInChI=1S/C14H23NO2/c1-10(2)14(17-5)13(15-3)11-7-6-8-12(9-11)16-4/h6-10,13-15H,1-5H3
InChIKeyGGPJRKBLRIENCU-UHFFFAOYSA-N
XLogP2.63
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-1-(3-methoxyphenyl)-3-methyl-N-propylbutan-1-amine
CID 116720561
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1-(3-methoxyphenyl)-2-(methylamino)propan-1-ol
CID 82281926
2-ethoxy-1-(3-methoxyphenyl)-N-methylbutan-1-amine
CID 116716598
1-methoxy-3-[3-(3-methoxyphenyl)butan-2-yl]benzene
CID 12861418
[(1R)-1-(3-methoxyphenyl)ethyl]-trimethylsilane
CID 132551583
2-methoxy-N,3-dimethyl-1-quinolin-6-ylbutan-1-amine
CID 116720092
1-(3,4-diethoxyphenyl)-2-methoxy-N,3-dimethylbutan-1-amine
CID 116720003
(1R)-1-(3-methoxyphenyl)ethanol
CID 10219539
1-(3-methoxyphenyl)-2,3-dimethylbutan-1-ol
CID 114976753
1-[(1S)-1-isothiocyanatoethyl]-3-methoxybenzene
CID 7018250
N-ethynyl-1-(3-methoxyphenyl)ethanamine
CID 145298325

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine?
The IUPAC name of 2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine (CID 116719987) is 2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine.
What is the SMILES notation for 2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine?
The canonical SMILES for 2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine is CNC(c1cccc(OC)c1)C(OC)C(C)C.
What is the InChIKey of 2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine?
The InChIKey is GGPJRKBLRIENCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-10(2)14(17-5)13(15-3)11-7-6-8-12(9-11)16-4/h6-10,13-15H,1-5H3.
What are the key properties of 2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine?
2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine has a molecular weight of 237.34 g/mol, XLogP of 2.63, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine is sourced from PubChem (CID 116719987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).