6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine

C18H13Cl3N2O — CID 142720961

IUPAC6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine
SMILESNc1ccc(OC(c2ccc(Cl)cc2)c2ccc(Cl)cc2Cl)nc1
InChIInChI=1S/C18H13Cl3N2O/c19-12-3-1-11(2-4-12)18(15-7-5-13(20)9-16(15)21)24-17-8-6-14(22)10-23-17/h1-10,18H,22H2
InChIKeyFRLDAQQFEVTYIZ-UHFFFAOYSA-N
MW379.67 g/mol
LogP5.79
Rot. Bonds4

About 6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine

6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine (PubChem CID 142720961) has the molecular formula C18H13Cl3N2O and a molecular weight of 379.67 g/mol. Its IUPAC name is 6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine.

Molecular Properties

Compound Name6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine
PubChem CID142720961
Molecular FormulaC18H13Cl3N2O
Molecular Weight379.67 g/mol
Exact Mass378.01
IUPAC Name6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine
SMILESNc1ccc(OC(c2ccc(Cl)cc2)c2ccc(Cl)cc2Cl)nc1
InChIInChI=1S/C18H13Cl3N2O/c19-12-3-1-11(2-4-12)18(15-7-5-13(20)9-16(15)21)24-17-8-6-14(22)10-23-17/h1-10,18H,22H2
InChIKeyFRLDAQQFEVTYIZ-UHFFFAOYSA-N
XLogP5.79
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.67
LogP ≤ 55.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyrazine-2-carboxylic acid
CID 142720957
4-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]-3-fluoroaniline
CID 88990967
[6-[(S)-(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridazin-3-yl]-pyrrolidin-1-ylmethanone
CID 142720954
O-[(2,4-dichlorophenyl)-phenylmethyl]hydroxylamine;hydrochloride
CID 155564613
2-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]-N-(1-hydroxy-2-methylpropan-2-yl)pyrimidine-5-carboxamide
CID 86302715
(R)-(4-amino-2-chlorophenyl)-(4-chlorophenyl)methanol
CID 27260955
3-chloro-4-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]aniline
CID 22557387
1-chloro-4-propan-2-ylbenzene;2,4-dichloro-1-propan-2-ylbenzene
CID 158524706
6-(6-chloropyrimidin-4-yl)oxypyridin-3-amine
CID 90020695
6-(4-chlorophenoxy)pyridine-3,4-diamine
CID 129032482
[(4-chlorophenyl)-(3,5-dichloro-2-pyridinyl)methyl]hydrazine
CID 105248688
5-chloro-2-(2,4-dichlorophenoxy)pyridine
CID 66232986

Frequently Asked Questions

What is the IUPAC name of 6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine?
The IUPAC name of 6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine (CID 142720961) is 6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine.
What is the SMILES notation for 6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine?
The canonical SMILES for 6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine is Nc1ccc(OC(c2ccc(Cl)cc2)c2ccc(Cl)cc2Cl)nc1.
What is the InChIKey of 6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine?
The InChIKey is FRLDAQQFEVTYIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl3N2O/c19-12-3-1-11(2-4-12)18(15-7-5-13(20)9-16(15)21)24-17-8-6-14(22)10-23-17/h1-10,18H,22H2.
What are the key properties of 6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine?
6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine has a molecular weight of 379.67 g/mol, XLogP of 5.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-chlorophenyl)-(2,4-dichlorophenyl)methoxy]pyridin-3-amine is sourced from PubChem (CID 142720961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).