N-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine

C19H25NO — CID 60957806

IUPACN-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine
SMILESCCOc1cccc(CNCC(C)(C)c2ccccc2)c1
InChIInChI=1S/C19H25NO/c1-4-21-18-12-8-9-16(13-18)14-20-15-19(2,3)17-10-6-5-7-11-17/h5-13,20H,4,14-15H2,1-3H3
InChIKeyUHFIVOAZZLBLJL-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.15
Rot. Bonds7

About N-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine

N-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine (PubChem CID 60957806) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is N-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine.

Molecular Properties

Compound NameN-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine
PubChem CID60957806
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC NameN-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine
SMILESCCOc1cccc(CNCC(C)(C)c2ccccc2)c1
InChIInChI=1S/C19H25NO/c1-4-21-18-12-8-9-16(13-18)14-20-15-19(2,3)17-10-6-5-7-11-17/h5-13,20H,4,14-15H2,1-3H3
InChIKeyUHFIVOAZZLBLJL-UHFFFAOYSA-N
XLogP4.15
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(3-ethoxyphenyl)methylamino]-2-methylpropane-1,2-diol
CID 66168780
N-[(3-chlorophenyl)methyl]-2-methyl-2-phenylpropan-1-amine
CID 63452100
2-[(3-ethoxyphenyl)methylamino]-2-phenylpropan-1-ol
CID 115630491
1-(4-ethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]methanamine
CID 60776460
1-(3-ethoxyphenyl)-N-phenylmethoxymethanamine
CID 82708969
N-[(3-ethoxyphenyl)methyl]prop-2-yn-1-amine
CID 60873507
1-[(4-ethoxyphenyl)methylamino]-2-phenylpropan-2-ol
CID 111121689
4-[[(3-ethoxyphenyl)methylamino]methyl]phenol
CID 60777598
N-[(3-ethoxyphenyl)methyl]pentan-1-amine
CID 4717531
N-[(3-ethoxyphenyl)methyl]-1-pyridin-4-ylmethanamine
CID 2227150
1-(4-tert-butylphenyl)-N-[[3-(2-phenoxyethoxy)phenyl]methyl]methanamine
CID 54804575
2-(2,5-dimethylfuran-3-yl)-1-[(3-ethoxyphenyl)methylamino]propan-2-ol
CID 111467685

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine?
The IUPAC name of N-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine (CID 60957806) is N-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine.
What is the SMILES notation for N-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine?
The canonical SMILES for N-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine is CCOc1cccc(CNCC(C)(C)c2ccccc2)c1.
What is the InChIKey of N-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine?
The InChIKey is UHFIVOAZZLBLJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-4-21-18-12-8-9-16(13-18)14-20-15-19(2,3)17-10-6-5-7-11-17/h5-13,20H,4,14-15H2,1-3H3.
What are the key properties of N-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine?
N-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 4.15, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethoxyphenyl)methyl]-2-methyl-2-phenylpropan-1-amine is sourced from PubChem (CID 60957806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).