1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine

C15H16ClNO — CID 43189009

IUPAC1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine
SMILESCC(N)c1ccc(OCc2ccccc2Cl)cc1
InChIInChI=1S/C15H16ClNO/c1-11(17)12-6-8-14(9-7-12)18-10-13-4-2-3-5-15(13)16/h2-9,11H,10,17H2,1H3
InChIKeyKSSIJBYTMSPOAY-UHFFFAOYSA-N
MW261.75 g/mol
LogP3.94
Rot. Bonds4

About 1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine

1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine (PubChem CID 43189009) has the molecular formula C15H16ClNO and a molecular weight of 261.75 g/mol. Its IUPAC name is 1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine.

Molecular Properties

Compound Name1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine
PubChem CID43189009
Molecular FormulaC15H16ClNO
Molecular Weight261.75 g/mol
Exact Mass261.09
IUPAC Name1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine
SMILESCC(N)c1ccc(OCc2ccccc2Cl)cc1
InChIInChI=1S/C15H16ClNO/c1-11(17)12-6-8-14(9-7-12)18-10-13-4-2-3-5-15(13)16/h2-9,11H,10,17H2,1H3
InChIKeyKSSIJBYTMSPOAY-UHFFFAOYSA-N
XLogP3.94
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.75
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-bis[(2-chlorophenyl)methoxy]benzene
CID 18515510
(1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine
CID 78933581
(R)-[4-[(2-chlorophenyl)methoxy]phenyl]-cyclopropylmethanamine
CID 165351367
(1R)-1-[5-[(2-chlorophenyl)methoxy]-2-pyridinyl]ethanamine
CID 83127678
1-[4-[(2-chlorophenyl)methoxy]phenyl]-N-ethylethanamine
CID 43285011
(1R)-1-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]ethanamine
CID 63367550
1-[4-[(2-chlorophenyl)methoxy]phenyl]-N-ethylpropan-1-amine
CID 63500455
(1R)-1-[4-[(4-chloro-2-fluorophenyl)methoxy]phenyl]ethanamine
CID 104980107
4-[(2-chlorophenyl)methoxy]-N-[1-(4-methoxyphenyl)ethyl]benzamide
CID 132763399
(1S)-1-[4-[(4-propan-2-ylphenyl)methoxy]phenyl]ethanamine
CID 28973753
N-[1-(4-tert-butylphenyl)ethyl]-4-[(2-chlorophenyl)methoxy]benzamide
CID 132666759
ethane;(1S)-1-[4-(phenoxymethyl)phenyl]ethanamine
CID 154659540

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine?
The IUPAC name of 1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine (CID 43189009) is 1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine.
What is the SMILES notation for 1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine?
The canonical SMILES for 1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine is CC(N)c1ccc(OCc2ccccc2Cl)cc1.
What is the InChIKey of 1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine?
The InChIKey is KSSIJBYTMSPOAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO/c1-11(17)12-6-8-14(9-7-12)18-10-13-4-2-3-5-15(13)16/h2-9,11H,10,17H2,1H3.
What are the key properties of 1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine?
1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine has a molecular weight of 261.75 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine is sourced from PubChem (CID 43189009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).