1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine

C12H19NO — CID 117284120

IUPAC1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine
SMILESCOc1ccc(C)c(C)c1CC(C)N
InChIInChI=1S/C12H19NO/c1-8-5-6-12(14-4)11(10(8)3)7-9(2)13/h5-6,9H,7,13H2,1-4H3
InChIKeyJMFCBRXWLQQPIE-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.20
Rot. Bonds3

About 1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine

1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine (PubChem CID 117284120) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine.

Molecular Properties

Compound Name1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine
PubChem CID117284120
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine
SMILESCOc1ccc(C)c(C)c1CC(C)N
InChIInChI=1S/C12H19NO/c1-8-5-6-12(14-4)11(10(8)3)7-9(2)13/h5-6,9H,7,13H2,1-4H3
InChIKeyJMFCBRXWLQQPIE-UHFFFAOYSA-N
XLogP2.20
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-bromo-3-fluoro-6-methoxyphenyl)propan-2-amine
CID 83902067
2-butyl-1-methoxy-3,4-dimethylbenzene
CID 150631165
(2S)-1-(2-bromo-6-methoxyphenyl)propan-2-amine
CID 130691963
1-(6-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)propan-2-amine
CID 117319889
2-(6-methoxy-2,3-dimethylphenyl)propan-1-amine
CID 117284105
1-(3,5-dimethoxy-4-methylphenyl)propan-2-amine;hydrochloride
CID 168891432
triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane
CID 59566888
1-(7-chloro-4-methoxy-2-methyl-1H-indol-3-yl)propan-2-amine
CID 82499491
1-N-(4-methoxy-2,3-dimethylphenyl)-1-N-methylpropane-1,2-diamine
CID 115196412
(2R)-1-(2,6-dimethylphenyl)propan-2-amine;hydrochloride
CID 175702028
1-(2,6-dimethoxy-4-methylsulfanylphenyl)propan-2-amine
CID 11300389
1-[2-chloro-6-(2-methoxy-4-methylphenoxy)phenyl]propan-2-amine
CID 63815045

Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine?
The IUPAC name of 1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine (CID 117284120) is 1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine.
What is the SMILES notation for 1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine?
The canonical SMILES for 1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine is COc1ccc(C)c(C)c1CC(C)N.
What is the InChIKey of 1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine?
The InChIKey is JMFCBRXWLQQPIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-8-5-6-12(14-4)11(10(8)3)7-9(2)13/h5-6,9H,7,13H2,1-4H3.
What are the key properties of 1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine?
1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine has a molecular weight of 193.29 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine is sourced from PubChem (CID 117284120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).