N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine

C18H23NO — CID 63640314

IUPACN-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine
SMILESCCNC(C)c1ccc(C)cc1OCc1ccccc1
InChIInChI=1S/C18H23NO/c1-4-19-15(3)17-11-10-14(2)12-18(17)20-13-16-8-6-5-7-9-16/h5-12,15,19H,4,13H2,1-3H3
InChIKeyJJKMNORUGIWTFY-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.24
Rot. Bonds6

About N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine

N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine (PubChem CID 63640314) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine
PubChem CID63640314
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC NameN-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine
SMILESCCNC(C)c1ccc(C)cc1OCc1ccccc1
InChIInChI=1S/C18H23NO/c1-4-19-15(3)17-11-10-14(2)12-18(17)20-13-16-8-6-5-7-9-16/h5-12,15,19H,4,13H2,1-3H3
InChIKeyJJKMNORUGIWTFY-UHFFFAOYSA-N
XLogP4.24
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-[(4-bromophenyl)methoxy]-4-methylphenyl]-N-ethylethanamine
CID 63640996
1-[2-[(3-bromophenyl)methoxy]-4-methylphenyl]-N-ethylethanamine
CID 63640634
1-(4-bromo-2-phenylmethoxyphenyl)-N-ethylethanamine
CID 82976068
N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine
CID 43279645
N-ethyl-1-(4-methyl-2-prop-2-enoxyphenyl)ethanamine
CID 63640648
N-ethyl-1-[4-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanamine
CID 79262667
1-[2-(2-ethoxyethoxy)-4-methylphenyl]-N-ethylethanamine
CID 63640644
1-[2-(3-ethoxypropoxy)-4-methylphenyl]-N-ethylethanamine
CID 65176576
N-ethyl-1-[4-methyl-2-(2,2,2-trifluoroethoxy)phenyl]ethanamine
CID 63641162
N-ethyl-1-[4-methyl-2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanamine
CID 63640834
1-[2-[(3-chlorophenyl)methoxy]-5-methylphenyl]-N-ethylethanamine
CID 63500464
1-[2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]-4-methylphenyl]-N-ethylethanamine
CID 63640814

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine?
The IUPAC name of N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine (CID 63640314) is N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine.
What is the SMILES notation for N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine?
The canonical SMILES for N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine is CCNC(C)c1ccc(C)cc1OCc1ccccc1.
What is the InChIKey of N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine?
The InChIKey is JJKMNORUGIWTFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-4-19-15(3)17-11-10-14(2)12-18(17)20-13-16-8-6-5-7-9-16/h5-12,15,19H,4,13H2,1-3H3.
What are the key properties of N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine?
N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine has a molecular weight of 269.39 g/mol, XLogP of 4.24, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine is sourced from PubChem (CID 63640314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).