1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine

C15H25NO — CID 94686610

IUPAC1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine
SMILESCNC(C)(C)Cc1cc(C(C)C)ccc1OC
InChIInChI=1S/C15H25NO/c1-11(2)12-7-8-14(17-6)13(9-12)10-15(3,4)16-5/h7-9,11,16H,10H2,1-6H3
InChIKeyWGPLAUNHBUXWHJ-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.36
Rot. Bonds5

About 1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine

1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine (PubChem CID 94686610) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is 1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine.

Molecular Properties

Compound Name1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine
PubChem CID94686610
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine
SMILESCNC(C)(C)Cc1cc(C(C)C)ccc1OC
InChIInChI=1S/C15H25NO/c1-11(2)12-7-8-14(17-6)13(9-12)10-15(3,4)16-5/h7-9,11,16H,10H2,1-6H3
InChIKeyWGPLAUNHBUXWHJ-UHFFFAOYSA-N
XLogP3.36
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 3-(2-methoxy-5-propan-2-ylphenyl)-2,2-dimethylpropanoate
CID 116927536
2-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-2-methylpropane-1,2-diamine
CID 115131889
4-[(2-methoxy-5-propan-2-ylphenyl)methyl]-N-methylaniline
CID 116926089
1-(2-methoxy-5-propan-2-ylphenyl)-N,3-dimethylbutan-2-amine
CID 112513404
[(2-methoxy-5-propan-2-ylphenyl)methylamino]methanethiol
CID 115227896
2-(2-methoxy-5-propan-2-ylphenyl)-N,N-dimethylethanamine
CID 117043743
N-(hydrazinylmethyl)-2-(2-methoxy-5-propan-2-ylphenyl)-N-methylethanamine
CID 115261259
N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide
CID 110780628
4-[(2-methoxy-5-propan-2-ylphenyl)methoxy]aniline
CID 82354174
N-cyclopentyl-2-(2-methoxy-5-propan-2-ylphenyl)acetamide
CID 110767613
2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide
CID 94687136
[3-[(2-methoxy-5-propan-2-ylphenyl)methyl]phenyl]methanamine
CID 116926185

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine?
The IUPAC name of 1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine (CID 94686610) is 1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine.
What is the SMILES notation for 1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine?
The canonical SMILES for 1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine is CNC(C)(C)Cc1cc(C(C)C)ccc1OC.
What is the InChIKey of 1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine?
The InChIKey is WGPLAUNHBUXWHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-11(2)12-7-8-14(17-6)13(9-12)10-15(3,4)16-5/h7-9,11,16H,10H2,1-6H3.
What are the key properties of 1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine?
1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine has a molecular weight of 235.37 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-5-propan-2-ylphenyl)-N,2-dimethylpropan-2-amine is sourced from PubChem (CID 94686610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).