4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine

C15H14Cl2N2O — CID 45486198

IUPAC4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine
SMILESClc1ccc(-c2ccc(N3CCOCC3)nc2)cc1Cl
InChIInChI=1S/C15H14Cl2N2O/c16-13-3-1-11(9-14(13)17)12-2-4-15(18-10-12)19-5-7-20-8-6-19/h1-4,9-10H,5-8H2
InChIKeyDEXIBZJBTZFQKZ-UHFFFAOYSA-N
MW309.20 g/mol
LogP3.89
Rot. Bonds2

About 4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine

4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine (PubChem CID 45486198) has the molecular formula C15H14Cl2N2O and a molecular weight of 309.20 g/mol. Its IUPAC name is 4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine
PubChem CID45486198
Molecular FormulaC15H14Cl2N2O
Molecular Weight309.20 g/mol
Exact Mass308.05
IUPAC Name4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine
SMILESClc1ccc(-c2ccc(N3CCOCC3)nc2)cc1Cl
InChIInChI=1S/C15H14Cl2N2O/c16-13-3-1-11(9-14(13)17)12-2-4-15(18-10-12)19-5-7-20-8-6-19/h1-4,9-10H,5-8H2
InChIKeyDEXIBZJBTZFQKZ-UHFFFAOYSA-N
XLogP3.89
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.20
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine?
The IUPAC name of 4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine (CID 45486198) is 4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine?
The canonical SMILES for 4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine is Clc1ccc(-c2ccc(N3CCOCC3)nc2)cc1Cl.
What is the InChIKey of 4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine?
The InChIKey is DEXIBZJBTZFQKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O/c16-13-3-1-11(9-14(13)17)12-2-4-15(18-10-12)19-5-7-20-8-6-19/h1-4,9-10H,5-8H2.
What are the key properties of 4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine?
4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine has a molecular weight of 309.20 g/mol, XLogP of 3.89, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(3,4-dichlorophenyl)-2-pyridinyl]morpholine is sourced from PubChem (CID 45486198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).