6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide

C17H12Cl2N4O2 — CID 166216580

IUPAC6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide
SMILESNc1ncc(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)cc1Cl
InChIInChI=1S/C17H12Cl2N4O2/c18-11-1-6-15(21-9-11)25-13-4-2-12(3-5-13)23-17(24)10-7-14(19)16(20)22-8-10/h1-9H,(H2,20,22)(H,23,24)
InChIKeyNAEBULDMWRBHCV-UHFFFAOYSA-N
MW375.22 g/mol
LogP4.41
Rot. Bonds4

About 6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide

6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide (PubChem CID 166216580) has the molecular formula C17H12Cl2N4O2 and a molecular weight of 375.22 g/mol. Its IUPAC name is 6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide
PubChem CID166216580
Molecular FormulaC17H12Cl2N4O2
Molecular Weight375.22 g/mol
Exact Mass374.03
IUPAC Name6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide
SMILESNc1ncc(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)cc1Cl
InChIInChI=1S/C17H12Cl2N4O2/c18-11-1-6-15(21-9-11)25-13-4-2-12(3-5-13)23-17(24)10-7-14(19)16(20)22-8-10/h1-9H,(H2,20,22)(H,23,24)
InChIKeyNAEBULDMWRBHCV-UHFFFAOYSA-N
XLogP4.41
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.22
LogP ≤ 54.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide?
The IUPAC name of 6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide (CID 166216580) is 6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide?
The canonical SMILES for 6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide is Nc1ncc(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)cc1Cl.
What is the InChIKey of 6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide?
The InChIKey is NAEBULDMWRBHCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2N4O2/c18-11-1-6-15(21-9-11)25-13-4-2-12(3-5-13)23-17(24)10-7-14(19)16(20)22-8-10/h1-9H,(H2,20,22)(H,23,24).
What are the key properties of 6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide?
6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide has a molecular weight of 375.22 g/mol, XLogP of 4.41, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 166216580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).