2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine

C12H19NO — CID 65053223

IUPAC2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine
SMILESCc1cccc(COC(C)(C)CN)c1
InChIInChI=1S/C12H19NO/c1-10-5-4-6-11(7-10)8-14-12(2,3)9-13/h4-7H,8-9,13H2,1-3H3
InChIKeyVYCIFZUKLBWHSJ-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.25
Rot. Bonds4

About 2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine

2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine (PubChem CID 65053223) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine.

Molecular Properties

Compound Name2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine
PubChem CID65053223
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine
SMILESCc1cccc(COC(C)(C)CN)c1
InChIInChI=1S/C12H19NO/c1-10-5-4-6-11(7-10)8-14-12(2,3)9-13/h4-7H,8-9,13H2,1-3H3
InChIKeyVYCIFZUKLBWHSJ-UHFFFAOYSA-N
XLogP2.25
TPSA35.25 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 ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-2-[(4-methylphenyl)methoxy]propan-1-amine
CID 65053113
1-methyl-3-[(3-methylphenyl)methoxymethyl]benzene
CID 15640186
1-(2,2-dimethylpropoxymethyl)-3-methylbenzene
CID 91703784
tert-butyl-dimethyl-[(3-methylphenyl)methoxy]silane
CID 22967275
(3-methylphenyl)methyl N-methylethanimidate
CID 167446851
(3-methylphenyl)methanamine;hydrochloride
CID 18670917
1-methyl-3-(propan-2-yloxymethyl)benzene
CID 10464662
(2S)-1-[(3-methylphenyl)methoxy]butan-2-amine
CID 97057916
2-(3-methylphenyl)ethanamine;hydrochloride
CID 47003273
2-N-ethyl-2-methyl-2-N-[(3-methylphenyl)methyl]propane-1,2-diamine
CID 62007965
3-[(3-methylphenyl)methoxy]phenol
CID 39243397
2,2-difluoro-4-(3-methylphenyl)butan-1-amine
CID 118527282

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine?
The IUPAC name of 2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine (CID 65053223) is 2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine.
What is the SMILES notation for 2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine?
The canonical SMILES for 2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine is Cc1cccc(COC(C)(C)CN)c1.
What is the InChIKey of 2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine?
The InChIKey is VYCIFZUKLBWHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-10-5-4-6-11(7-10)8-14-12(2,3)9-13/h4-7H,8-9,13H2,1-3H3.
What are the key properties of 2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine?
2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine has a molecular weight of 193.29 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(3-methylphenyl)methoxy]propan-1-amine is sourced from PubChem (CID 65053223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).