2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide

C17H15Cl2N3O2 — CID 59618171

IUPAC2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide
SMILESO=C(Nc1ccnc(NC(=O)C2CCC2)c1)c1c(Cl)cccc1Cl
InChIInChI=1S/C17H15Cl2N3O2/c18-12-5-2-6-13(19)15(12)17(24)21-11-7-8-20-14(9-11)22-16(23)10-3-1-4-10/h2,5-10H,1,3-4H2,(H2,20,21,22,23,24)
InChIKeyYJMGZFGQBBEAQT-UHFFFAOYSA-N
MW364.23 g/mol
LogP4.38
Rot. Bonds4

About 2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide

2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide (PubChem CID 59618171) has the molecular formula C17H15Cl2N3O2 and a molecular weight of 364.23 g/mol. Its IUPAC name is 2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide
PubChem CID59618171
Molecular FormulaC17H15Cl2N3O2
Molecular Weight364.23 g/mol
Exact Mass363.05
IUPAC Name2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide
SMILESO=C(Nc1ccnc(NC(=O)C2CCC2)c1)c1c(Cl)cccc1Cl
InChIInChI=1S/C17H15Cl2N3O2/c18-12-5-2-6-13(19)15(12)17(24)21-11-7-8-20-14(9-11)22-16(23)10-3-1-4-10/h2,5-10H,1,3-4H2,(H2,20,21,22,23,24)
InChIKeyYJMGZFGQBBEAQT-UHFFFAOYSA-N
XLogP4.38
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.23
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide?
The IUPAC name of 2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide (CID 59618171) is 2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide is O=C(Nc1ccnc(NC(=O)C2CCC2)c1)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide?
The InChIKey is YJMGZFGQBBEAQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15Cl2N3O2/c18-12-5-2-6-13(19)15(12)17(24)21-11-7-8-20-14(9-11)22-16(23)10-3-1-4-10/h2,5-10H,1,3-4H2,(H2,20,21,22,23,24).
What are the key properties of 2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide?
2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide has a molecular weight of 364.23 g/mol, XLogP of 4.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide is sourced from PubChem (CID 59618171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).