4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine

C13H21NO2 — CID 65313648

IUPAC4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine
SMILESCOCCC(C)(N)c1ccc(OC)cc1C
InChIInChI=1S/C13H21NO2/c1-10-9-11(16-4)5-6-12(10)13(2,14)7-8-15-3/h5-6,9H,7-8,14H2,1-4H3
InChIKeyOKJLUTJHRPQALV-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.21
Rot. Bonds5

About 4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine

4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine (PubChem CID 65313648) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine.

Molecular Properties

Compound Name4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine
PubChem CID65313648
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine
SMILESCOCCC(C)(N)c1ccc(OC)cc1C
InChIInChI=1S/C13H21NO2/c1-10-9-11(16-4)5-6-12(10)13(2,14)7-8-15-3/h5-6,9H,7-8,14H2,1-4H3
InChIKeyOKJLUTJHRPQALV-UHFFFAOYSA-N
XLogP2.21
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-amine
CID 65313598
2-(2,4-dimethoxyphenyl)-1-methoxypropan-2-amine
CID 62801794
2-(3-fluoro-4-methylphenyl)-4-methoxybutan-2-amine
CID 107128253
1-(2-fluorophenyl)-1-(4-methoxy-2-methylphenyl)propan-1-amine
CID 115996402
2-(2-chloro-5-fluorophenyl)-4-methoxybutan-2-amine
CID 105394111
4-methoxy-2-(4-propan-2-yloxyphenyl)butan-2-amine
CID 62795409
1-(2-amino-4-methoxyanilino)-4-methoxy-2-methylbutan-2-ol
CID 114164064
2-tert-butyl-4-methoxy-1-methylbenzene;hydrofluoride
CID 157336845
3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol
CID 65313856
4-methoxy-2-(5-methylthiophen-3-yl)butan-2-amine
CID 65100154
5-(2-tert-butyl-4-methoxyphenoxy)-2,2-dimethylpentan-1-amine
CID 65256212
4-methoxy-N-(3-methoxy-2-methylpropyl)-2-methylaniline
CID 116501292

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine?
The IUPAC name of 4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine (CID 65313648) is 4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine.
What is the SMILES notation for 4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine?
The canonical SMILES for 4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine is COCCC(C)(N)c1ccc(OC)cc1C.
What is the InChIKey of 4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine?
The InChIKey is OKJLUTJHRPQALV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-10-9-11(16-4)5-6-12(10)13(2,14)7-8-15-3/h5-6,9H,7-8,14H2,1-4H3.
What are the key properties of 4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine?
4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine has a molecular weight of 223.32 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine is sourced from PubChem (CID 65313648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).