N,2-dimethyl-1-(2-methylphenoxy)propan-2-amine

C12H19NO — CID 82125739

IUPACN,2-dimethyl-1-(2-methylphenoxy)propan-2-amine
SMILESCNC(C)(C)COc1ccccc1C
InChIInChI=1S/C12H19NO/c1-10-7-5-6-8-11(10)14-9-12(2,3)13-4/h5-8,13H,9H2,1-4H3
InChIKeyVJHPUEXTZXLCAF-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.37
Rot. Bonds4

About N,2-dimethyl-1-(2-methylphenoxy)propan-2-amine

N,2-dimethyl-1-(2-methylphenoxy)propan-2-amine (PubChem CID 82125739) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is N,2-dimethyl-1-(2-methylphenoxy)propan-2-amine.

Molecular Properties

Compound NameN,2-dimethyl-1-(2-methylphenoxy)propan-2-amine
PubChem CID82125739
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC NameN,2-dimethyl-1-(2-methylphenoxy)propan-2-amine
SMILESCNC(C)(C)COc1ccccc1C
InChIInChI=1S/C12H19NO/c1-10-7-5-6-8-11(10)14-9-12(2,3)13-4/h5-8,13H,9H2,1-4H3
InChIKeyVJHPUEXTZXLCAF-UHFFFAOYSA-N
XLogP2.37
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 ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-dimethyl-4-(2-methylphenoxy)butan-2-amine
CID 94681294
1-(2-chlorophenoxy)-N,2-dimethylpropan-2-amine
CID 82126890
1-methyl-2-(2,2,3,3-tetramethylbutoxy)benzene
CID 158477998
ethane;2-methyl-1-(2-methylphenoxy)propan-2-ol
CID 177208153
N-ethyl-2,2-dimethyl-3-(2-methylphenoxy)propan-1-amine
CID 79626871
N-[2-methyl-1-(2-methylphenoxy)propan-2-yl]quinazolin-4-amine
CID 20545409
2,2-dimethyl-3-(2-methylphenoxy)propanethioamide
CID 82080504
1-(2,4-difluorophenoxy)-N,2-dimethylpropan-2-amine
CID 82126938
2-methyl-3-(2-methylphenoxy)-2-(propan-2-ylamino)propan-1-ol
CID 64802104
N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide
CID 110834301
[(1R,5S)-3-methyl-3-azabicyclo[3.1.0]hexan-6-yl]-[[2-methyl-1-(2-methylphenoxy)propan-2-yl]amino]methanol
CID 152937491
N-methyl-2-(2-methylphenoxy)ethanamine;hydrochloride
CID 17178031

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-1-(2-methylphenoxy)propan-2-amine?
The IUPAC name of N,2-dimethyl-1-(2-methylphenoxy)propan-2-amine (CID 82125739) is N,2-dimethyl-1-(2-methylphenoxy)propan-2-amine.
What is the SMILES notation for N,2-dimethyl-1-(2-methylphenoxy)propan-2-amine?
The canonical SMILES for N,2-dimethyl-1-(2-methylphenoxy)propan-2-amine is CNC(C)(C)COc1ccccc1C.
What is the InChIKey of N,2-dimethyl-1-(2-methylphenoxy)propan-2-amine?
The InChIKey is VJHPUEXTZXLCAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-10-7-5-6-8-11(10)14-9-12(2,3)13-4/h5-8,13H,9H2,1-4H3.
What are the key properties of N,2-dimethyl-1-(2-methylphenoxy)propan-2-amine?
N,2-dimethyl-1-(2-methylphenoxy)propan-2-amine has a molecular weight of 193.29 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-1-(2-methylphenoxy)propan-2-amine is sourced from PubChem (CID 82125739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).