(1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine

C18H23NO — CID 154810135

IUPAC(1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine
SMILESCOCc1ccc(CCN[C@H](C)c2ccccc2)cc1
InChIInChI=1S/C18H23NO/c1-15(18-6-4-3-5-7-18)19-13-12-16-8-10-17(11-9-16)14-20-2/h3-11,15,19H,12-14H2,1-2H3/t15-/m1/s1
InChIKeyRLUGRAMSDIGZMA-OAHLLOKOSA-N
MW269.39 g/mol
LogP3.73
Rot. Bonds7

About (1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine

(1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine (PubChem CID 154810135) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is (1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine.

Molecular Properties

Compound Name(1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine
PubChem CID154810135
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name(1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine
SMILESCOCc1ccc(CCN[C@H](C)c2ccccc2)cc1
InChIInChI=1S/C18H23NO/c1-15(18-6-4-3-5-7-18)19-13-12-16-8-10-17(11-9-16)14-20-2/h3-11,15,19H,12-14H2,1-2H3/t15-/m1/s1
InChIKeyRLUGRAMSDIGZMA-OAHLLOKOSA-N
XLogP3.73
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[1-(2-phenylethylamino)ethyl]phenol
CID 43194109
4-(methoxymethyl)-N-(2-phenylethyl)aniline
CID 83961080
(1R)-1-(3-methylphenyl)-N-(2-phenylethyl)ethanamine
CID 81364217
N,N'-bis[(1R)-1-phenylethyl]propane-1,3-diamine
CID 12964090
(1S)-N-[[4-(methoxymethyl)phenyl]methyl]-1-pyridin-3-ylethanamine
CID 79032772
N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine
CID 43694648
N,N'-bis[(1R)-1-phenylethyl]heptane-1,7-diamine
CID 101387383
N-ethyl-2-[4-(1-phenylethoxymethyl)phenyl]ethanamine
CID 105349406
N-[(1R)-1-(4-methoxyphenyl)ethyl]-3-phenylpropan-1-amine
CID 29042009
N'-[(1R)-1-phenylethyl]-N-(2-phenylmethoxyethyl)ethane-1,2-diamine
CID 11850166
2-methoxy-4-[1-(2-phenylethylamino)ethyl]phenol
CID 43194110
N-[2-(4-fluorophenyl)ethyl]-1-(3-methoxyphenyl)ethanamine
CID 43191768

Frequently Asked Questions

What is the IUPAC name of (1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine?
The IUPAC name of (1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine (CID 154810135) is (1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine.
What is the SMILES notation for (1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine?
The canonical SMILES for (1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine is COCc1ccc(CCN[C@H](C)c2ccccc2)cc1.
What is the InChIKey of (1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine?
The InChIKey is RLUGRAMSDIGZMA-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H23NO/c1-15(18-6-4-3-5-7-18)19-13-12-16-8-10-17(11-9-16)14-20-2/h3-11,15,19H,12-14H2,1-2H3/t15-/m1/s1.
What are the key properties of (1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine?
(1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine has a molecular weight of 269.39 g/mol, XLogP of 3.73, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-[2-[4-(methoxymethyl)phenyl]ethyl]-1-phenylethanamine is sourced from PubChem (CID 154810135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).