1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine

C12H19NO — CID 82125732

IUPAC1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine
SMILESCNC(C)(C)Cc1cccc(OC)c1
InChIInChI=1S/C12H19NO/c1-12(2,13-3)9-10-6-5-7-11(8-10)14-4/h5-8,13H,9H2,1-4H3
InChIKeySGJIUCVOAUXYRH-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.24
Rot. Bonds4

About 1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine

1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine (PubChem CID 82125732) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine
PubChem CID82125732
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine
SMILESCNC(C)(C)Cc1cccc(OC)c1
InChIInChI=1S/C12H19NO/c1-12(2,13-3)9-10-6-5-7-11(8-10)14-4/h5-8,13H,9H2,1-4H3
InChIKeySGJIUCVOAUXYRH-UHFFFAOYSA-N
XLogP2.24
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]formamide
CID 121002353
3-(3-methoxyphenyl)-N,2,2-trimethylpropan-1-amine
CID 62724321
1-(3-methoxyphenyl)-2-propan-2-yloxypropan-2-ol
CID 91379820
2-chloro-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]acetamide
CID 94691468
1-chloro-N-[(3-methoxyphenyl)methyl]-2-methylpropan-2-amine
CID 65026569
3-(3-methoxyphenyl)-2,2-dimethylpropan-1-amine;hydrochloride
CID 86277152
ethane;1-(3-methoxyphenyl)-N-methylmethanamine
CID 142908093
1-methoxy-3-propylbenzene
CID 14270128
2-[(3-methoxyphenyl)methoxy]-N,2-dimethylpropan-1-amine
CID 62354804
2-[(3-methoxyphenyl)methyl]-2-methylpentan-1-amine
CID 62724090
2-[(3-methoxyphenyl)methyl]-2-methylbutanenitrile
CID 65378065
2-fluoro-2-[(3-methoxyphenyl)methyl]-3,3-dimethylbutan-1-amine
CID 112566569

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine?
The IUPAC name of 1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine (CID 82125732) is 1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine.
What is the SMILES notation for 1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine?
The canonical SMILES for 1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine is CNC(C)(C)Cc1cccc(OC)c1.
What is the InChIKey of 1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine?
The InChIKey is SGJIUCVOAUXYRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-12(2,13-3)9-10-6-5-7-11(8-10)14-4/h5-8,13H,9H2,1-4H3.
What are the key properties of 1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine?
1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine has a molecular weight of 193.29 g/mol, XLogP of 2.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine is sourced from PubChem (CID 82125732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).