N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine

C18H23NO — CID 43279645

IUPACN-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine
SMILESCCNC(C)c1ccccc1OCc1ccc(C)cc1
InChIInChI=1S/C18H23NO/c1-4-19-15(3)17-7-5-6-8-18(17)20-13-16-11-9-14(2)10-12-16/h5-12,15,19H,4,13H2,1-3H3
InChIKeyOQARNCARDAPKGD-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.24
Rot. Bonds6

About N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine

N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine (PubChem CID 43279645) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine
PubChem CID43279645
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC NameN-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine
SMILESCCNC(C)c1ccccc1OCc1ccc(C)cc1
InChIInChI=1S/C18H23NO/c1-4-19-15(3)17-7-5-6-8-18(17)20-13-16-11-9-14(2)10-12-16/h5-12,15,19H,4,13H2,1-3H3
InChIKeyOQARNCARDAPKGD-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

N-ethyl-1-(4-methyl-2-phenylmethoxyphenyl)ethanamine
CID 63640314
1-[2-[(4-methylphenyl)methoxy]phenyl]ethanol
CID 43504033
1-[2-[(4-bromophenyl)methoxy]-4-methylphenyl]-N-ethylethanamine
CID 63640996
N-ethyl-1-[2-(2-methylpropoxy)phenyl]ethanamine
CID 43279591
N-ethyl-1-[2-[(2-fluorophenyl)methoxy]phenyl]ethanamine
CID 43279629
1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol
CID 60882508
1-(2-ethoxyphenyl)-N-ethyl-2-(4-methylphenyl)ethanamine
CID 61066318
1-(4-bromo-2-phenylmethoxyphenyl)-N-ethylethanamine
CID 82976068
N-ethyl-1-[2-fluoro-4-[(4-methylphenyl)methoxy]phenyl]ethanamine
CID 107717110
1-[2-[(3-chlorophenyl)methoxy]-5-methylphenyl]-N-ethylethanamine
CID 63500464
1-[2-[(3-bromophenyl)methoxy]-4-methylphenyl]-N-ethylethanamine
CID 63640634
N-[[4-[(2-propan-2-ylphenoxy)methyl]phenyl]methyl]ethanamine
CID 62459431

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine?
The IUPAC name of N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine (CID 43279645) is N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine.
What is the SMILES notation for N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine?
The canonical SMILES for N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine is CCNC(C)c1ccccc1OCc1ccc(C)cc1.
What is the InChIKey of N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine?
The InChIKey is OQARNCARDAPKGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-4-19-15(3)17-7-5-6-8-18(17)20-13-16-11-9-14(2)10-12-16/h5-12,15,19H,4,13H2,1-3H3.
What are the key properties of N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine?
N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]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-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine is sourced from PubChem (CID 43279645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).