1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine

C19H25NO — CID 63325862

IUPAC1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine
SMILESCc1cc(C)cc(COc2ccc(C)cc2CC(C)N)c1
InChIInChI=1S/C19H25NO/c1-13-5-6-19(18(10-13)11-16(4)20)21-12-17-8-14(2)7-15(3)9-17/h5-10,16H,11-12,20H2,1-4H3
InChIKeyBUGHMFGAIBNKRW-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.08
Rot. Bonds5

About 1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine

1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine (PubChem CID 63325862) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine.

Molecular Properties

Compound Name1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine
PubChem CID63325862
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine
SMILESCc1cc(C)cc(COc2ccc(C)cc2CC(C)N)c1
InChIInChI=1S/C19H25NO/c1-13-5-6-19(18(10-13)11-16(4)20)21-12-17-8-14(2)7-15(3)9-17/h5-10,16H,11-12,20H2,1-4H3
InChIKeyBUGHMFGAIBNKRW-UHFFFAOYSA-N
XLogP4.08
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[2-(bromomethyl)-4-methylphenoxy]methyl]-3,5-dimethylbenzene
CID 63536416
(1S)-1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]ethanamine
CID 78936431
1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine
CID 65364966
1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63326290
1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63326375
1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]-N-methylmethanamine
CID 63322567
1-[5-methyl-2-(3-methylbutoxy)phenyl]propan-2-amine
CID 55200535
2-[2-(2-aminopropyl)-4-methylphenoxy]acetonitrile
CID 63326461
1-(5-methyl-2-prop-2-ynoxyphenyl)propan-2-amine
CID 63326075
1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63985125
ethyl 2-[2-(2-aminopropyl)-4-methylphenoxy]acetate
CID 63326114
1-[2-(cyclobutylmethoxy)-5-methylphenyl]propan-2-amine
CID 65459757

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine?
The IUPAC name of 1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine (CID 63325862) is 1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine.
What is the SMILES notation for 1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine?
The canonical SMILES for 1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine is Cc1cc(C)cc(COc2ccc(C)cc2CC(C)N)c1.
What is the InChIKey of 1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine?
The InChIKey is BUGHMFGAIBNKRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-13-5-6-19(18(10-13)11-16(4)20)21-12-17-8-14(2)7-15(3)9-17/h5-10,16H,11-12,20H2,1-4H3.
What are the key properties of 1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine?
1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine has a molecular weight of 283.42 g/mol, XLogP of 4.08, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine is sourced from PubChem (CID 63325862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).