N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine

C15H16ClN — CID 54911635

IUPACN-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine
SMILESCCNCc1ccccc1-c1ccc(Cl)cc1
InChIInChI=1S/C15H16ClN/c1-2-17-11-13-5-3-4-6-15(13)12-7-9-14(16)10-8-12/h3-10,17H,2,11H2,1H3
InChIKeyGYOHHRQRXDDCIO-UHFFFAOYSA-N
MW245.75 g/mol
LogP4.12
Rot. Bonds4

About N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine

N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine (PubChem CID 54911635) has the molecular formula C15H16ClN and a molecular weight of 245.75 g/mol. Its IUPAC name is N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine
PubChem CID54911635
Molecular FormulaC15H16ClN
Molecular Weight245.75 g/mol
Exact Mass245.10
IUPAC NameN-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine
SMILESCCNCc1ccccc1-c1ccc(Cl)cc1
InChIInChI=1S/C15H16ClN/c1-2-17-11-13-5-3-4-6-15(13)12-7-9-14(16)10-8-12/h3-10,17H,2,11H2,1H3
InChIKeyGYOHHRQRXDDCIO-UHFFFAOYSA-N
XLogP4.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.75
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[2-(4-propoxyphenyl)phenyl]methyl]ethanamine
CID 62796087
4-[[[2-(4-chlorophenyl)phenyl]methylamino]methyl]-N,N-dimethylbenzamide
CID 146147204
N-[[2-(4-propylphenyl)phenyl]methyl]propan-1-amine
CID 63424634
1-[[2-(4-chlorophenyl)phenyl]methyl]-3-(2-hydroxyethyl)urea
CID 110923275
1-chloro-4-[2-(2-methylbutyl)phenyl]benzene
CID 143786749
N-[[4-chloro-2-(3,4-diethylphenyl)phenyl]methyl]ethanamine
CID 115482556
N-[[2-(3-fluoro-5-methylphenyl)phenyl]methyl]ethanamine
CID 79691626
N-[[2-(4-propan-2-ylphenyl)phenyl]methyl]propan-1-amine
CID 63424719
2-(ethylaminomethyl)phenol
CID 12995218
4-amino-N-[[2-(4-chlorophenyl)phenyl]methyl]pentanamide
CID 120562027
(E)-but-2-enedioic acid;N-[(2-pyridin-4-ylphenyl)methyl]ethanamine
CID 175841368
1-chloro-4-[2-(4-ethylphenyl)phenyl]benzene
CID 166659313

Frequently Asked Questions

What is the IUPAC name of N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine?
The IUPAC name of N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine (CID 54911635) is N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine?
The canonical SMILES for N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine is CCNCc1ccccc1-c1ccc(Cl)cc1.
What is the InChIKey of N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine?
The InChIKey is GYOHHRQRXDDCIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN/c1-2-17-11-13-5-3-4-6-15(13)12-7-9-14(16)10-8-12/h3-10,17H,2,11H2,1H3.
What are the key properties of N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine?
N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine has a molecular weight of 245.75 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine is sourced from PubChem (CID 54911635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).