2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine

C14H23NO2 — CID 79616330

IUPAC2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine
SMILESCNC(c1ccc(OC(C)C)cc1)C(C)OC
InChIInChI=1S/C14H23NO2/c1-10(2)17-13-8-6-12(7-9-13)14(15-4)11(3)16-5/h6-11,14-15H,1-5H3
InChIKeyAOYGTYQPORVDKU-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.77
Rot. Bonds6

About 2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine

2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine (PubChem CID 79616330) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine
PubChem CID79616330
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine
SMILESCNC(c1ccc(OC(C)C)cc1)C(C)OC
InChIInChI=1S/C14H23NO2/c1-10(2)17-13-8-6-12(7-9-13)14(15-4)11(3)16-5/h6-11,14-15H,1-5H3
InChIKeyAOYGTYQPORVDKU-UHFFFAOYSA-N
XLogP2.77
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 ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-dimethyl-1-(4-propan-2-yloxyphenyl)butan-1-amine
CID 43485559
(1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine
CID 30049099
2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine
CID 79617048
3-amino-4-(methylamino)-4-(4-propan-2-yloxyphenyl)butanoic acid
CID 116957906
methyl 2-(methylamino)-2-(4-propan-2-yloxyphenyl)acetate
CID 54932725
2-methoxy-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine
CID 79617046
2,2-dimethoxy-1-(4-methoxyphenyl)-N-methylethanamine
CID 79492759
4-methoxy-N,3-dimethyl-1-(4-propan-2-yloxyphenyl)butan-1-amine
CID 105144752
2-(1-ethoxypropan-2-yloxy)-1-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 103487772
N-methyl-4-propan-2-yloxyaniline
CID 18002910
1-(difluoromethyl)-4-propan-2-yloxybenzene
CID 130057921
(1S)-1-(4-propan-2-yloxyphenyl)ethanamine
CID 7446792

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine?
The IUPAC name of 2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine (CID 79616330) is 2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine.
What is the SMILES notation for 2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine?
The canonical SMILES for 2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine is CNC(c1ccc(OC(C)C)cc1)C(C)OC.
What is the InChIKey of 2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine?
The InChIKey is AOYGTYQPORVDKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-10(2)17-13-8-6-12(7-9-13)14(15-4)11(3)16-5/h6-11,14-15H,1-5H3.
What are the key properties of 2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine?
2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine has a molecular weight of 237.34 g/mol, XLogP of 2.77, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine is sourced from PubChem (CID 79616330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).