N-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine

C19H25NO — CID 62715678

IUPACN-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine
SMILESCNC(COc1ccccc1)Cc1c(C)cc(C)cc1C
InChIInChI=1S/C19H25NO/c1-14-10-15(2)19(16(3)11-14)12-17(20-4)13-21-18-8-6-5-7-9-18/h5-11,17,20H,12-13H2,1-4H3
InChIKeyMLSXZSBLSSRWBH-UHFFFAOYSA-N
MW283.41 g/mol
LogP3.82
Rot. Bonds6

About N-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine

N-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine (PubChem CID 62715678) has the molecular formula C19H25NO and a molecular weight of 283.41 g/mol. Its IUPAC name is N-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine.

Molecular Properties

Compound NameN-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine
PubChem CID62715678
Molecular FormulaC19H25NO
Molecular Weight283.41 g/mol
Exact Mass283.19
IUPAC NameN-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine
SMILESCNC(COc1ccccc1)Cc1c(C)cc(C)cc1C
InChIInChI=1S/C19H25NO/c1-14-10-15(2)19(16(3)11-14)12-17(20-4)13-21-18-8-6-5-7-9-18/h5-11,17,20H,12-13H2,1-4H3
InChIKeyMLSXZSBLSSRWBH-UHFFFAOYSA-N
XLogP3.82
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-ol
CID 62714978
1-(2-methoxy-5-methylphenyl)-N-methyl-3-phenoxypropan-2-amine
CID 62715506
1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-2-phenoxyethanamine
CID 106680529
1-ethoxy-N-methyl-3-phenoxypropan-2-amine
CID 79574032
N-methyl-1-phenoxynonan-2-amine
CID 63416660
1-(4-chlorophenoxy)-N-methyl-3-phenylpropan-2-amine
CID 105084979
1-(3-chlorophenoxy)-N-methyl-3-phenylpropan-2-amine
CID 105084372
1-(3-chlorophenoxy)-3-(3,5-dimethylphenyl)-N-methylpropan-2-amine
CID 105098748
5-methoxy-N-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine
CID 65092092
N-methyl-1-(3-methylphenoxy)butan-2-amine
CID 62038283
4-methoxy-N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-2-amine
CID 103025022
N-methyl-1-propan-2-ylsulfanyl-3-(2,4,6-trimethylphenyl)propan-2-amine
CID 65132056

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine?
The IUPAC name of N-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine (CID 62715678) is N-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine.
What is the SMILES notation for N-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine?
The canonical SMILES for N-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine is CNC(COc1ccccc1)Cc1c(C)cc(C)cc1C.
What is the InChIKey of N-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine?
The InChIKey is MLSXZSBLSSRWBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-14-10-15(2)19(16(3)11-14)12-17(20-4)13-21-18-8-6-5-7-9-18/h5-11,17,20H,12-13H2,1-4H3.
What are the key properties of N-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine?
N-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine has a molecular weight of 283.41 g/mol, XLogP of 3.82, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-phenoxy-3-(2,4,6-trimethylphenyl)propan-2-amine is sourced from PubChem (CID 62715678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).