N-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine

C15H17ClN2O — CID 62290868

IUPACN-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1cc(OCc2ccccc2Cl)ccn1
InChIInChI=1S/C15H17ClN2O/c1-2-17-10-13-9-14(7-8-18-13)19-11-12-5-3-4-6-15(12)16/h3-9,17H,2,10-11H2,1H3
InChIKeyATACJIUWWGNCEH-UHFFFAOYSA-N
MW276.77 g/mol
LogP3.42
Rot. Bonds6

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

N-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine (PubChem CID 62290868) has the molecular formula C15H17ClN2O and a molecular weight of 276.77 g/mol. Its IUPAC name is N-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine
PubChem CID62290868
Molecular FormulaC15H17ClN2O
Molecular Weight276.77 g/mol
Exact Mass276.10
IUPAC NameN-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1cc(OCc2ccccc2Cl)ccn1
InChIInChI=1S/C15H17ClN2O/c1-2-17-10-13-9-14(7-8-18-13)19-11-12-5-3-4-6-15(12)16/h3-9,17H,2,10-11H2,1H3
InChIKeyATACJIUWWGNCEH-UHFFFAOYSA-N
XLogP3.42
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[3-[(2-chlorophenyl)methoxy]phenyl]methyl]ethanamine;hydrochloride
CID 17290789
N-[[2-[(3,4-dichlorophenoxy)methyl]phenyl]methyl]ethanamine
CID 63497555
N-[(4-prop-2-enoxy-2-pyridinyl)methyl]ethanamine
CID 62288081
1-[4-[(2-chlorophenyl)methoxy]phenyl]-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 6461106
N-[[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]methyl]ethanamine
CID 60878145
N-[[4-[2-(2-methoxyethoxy)ethoxy]-2-pyridinyl]methyl]ethanamine
CID 104566339
N-[[4-[(4-chlorophenyl)methoxy]-2-pyridinyl]methyl]propan-1-amine
CID 65125344
N-[[3-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl]ethanamine
CID 63499927
2-[2-[(3,4-dichlorophenoxy)methyl]phenyl]-N-ethylethanamine
CID 115464941
N-[[4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]methyl]ethanamine
CID 4716490
N-[[3-[(2-chlorophenyl)methoxy]phenyl]methyl]propan-1-amine;hydrochloride
CID 17290892
1,4-bis[(2-chlorophenyl)methoxy]benzene
CID 18515510

Frequently Asked Questions

What is the IUPAC name of N-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine (CID 62290868) is N-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine is CCNCc1cc(OCc2ccccc2Cl)ccn1.
What is the InChIKey of N-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine?
The InChIKey is ATACJIUWWGNCEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O/c1-2-17-10-13-9-14(7-8-18-13)19-11-12-5-3-4-6-15(12)16/h3-9,17H,2,10-11H2,1H3.
What are the key properties of N-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine?
N-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine has a molecular weight of 276.77 g/mol, XLogP of 3.42, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 62290868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).