5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide

C19H15Cl2N3O2 — CID 162659350

IUPAC5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide
SMILESO=C(Nc1ccc(NCc2ccncc2)cc1Cl)c1cc(Cl)ccc1O
InChIInChI=1S/C19H15Cl2N3O2/c20-13-1-4-18(25)15(9-13)19(26)24-17-3-2-14(10-16(17)21)23-11-12-5-7-22-8-6-12/h1-10,23,25H,11H2,(H,24,26)
InChIKeyYECNZOKDGFZQEQ-UHFFFAOYSA-N
MW388.25 g/mol
LogP4.96
Rot. Bonds5

About 5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide

5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide (PubChem CID 162659350) has the molecular formula C19H15Cl2N3O2 and a molecular weight of 388.25 g/mol. Its IUPAC name is 5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide
PubChem CID162659350
Molecular FormulaC19H15Cl2N3O2
Molecular Weight388.25 g/mol
Exact Mass387.05
IUPAC Name5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide
SMILESO=C(Nc1ccc(NCc2ccncc2)cc1Cl)c1cc(Cl)ccc1O
InChIInChI=1S/C19H15Cl2N3O2/c20-13-1-4-18(25)15(9-13)19(26)24-17-3-2-14(10-16(17)21)23-11-12-5-7-22-8-6-12/h1-10,23,25H,11H2,(H,24,26)
InChIKeyYECNZOKDGFZQEQ-UHFFFAOYSA-N
XLogP4.96
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.25
LogP ≤ 54.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(3-chloropyridin-4-yl)-2-hydroxybenzamide
CID 46836254
5-chloro-N-[2-chloro-4-[(6-oxo-1H-pyridin-3-yl)methylamino]phenyl]-2-hydroxybenzamide
CID 162651278
N-(5-chloro-2-hydroxyphenyl)-4-[(pyridin-4-ylamino)methyl]benzamide
CID 25218549
(E)-1-(5-chloro-2-hydroxyphenyl)-3-pyridin-4-ylprop-2-en-1-one
CID 5357374
5-chloro-2-hydroxy-N-(quinolin-8-yl)benzamide
CID 29786650
N-[4-[(6-bromo-2-pyridinyl)methylamino]-2-chlorophenyl]-5-chloro-2-hydroxybenzamide
CID 162653255
N-[4-(benzylamino)-2-chlorophenyl]-5-chloro-2-hydroxybenzamide
CID 162653811
5-chloro-N-[2-chloro-4-[(4-chloro-3-pyridinyl)methylamino]phenyl]-2-hydroxybenzamide
CID 162655386
5-chloro-N-[2-chloro-4-[(2-chloro-3-pyridinyl)methylamino]phenyl]-2-hydroxybenzamide
CID 162674843
5-chloro-2-hydroxy-N-(pyridin-4-yl)benzamide
CID 3011446
5-chloro-N-(6-chloro-3-pyridinyl)-2-hydroxybenzamide
CID 10379068
5-chloro-2-hydroxy-N-quinolin-3-ylbenzamide
CID 10402452

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide?
The IUPAC name of 5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide (CID 162659350) is 5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide.
What is the SMILES notation for 5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide?
The canonical SMILES for 5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide is O=C(Nc1ccc(NCc2ccncc2)cc1Cl)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide?
The InChIKey is YECNZOKDGFZQEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2N3O2/c20-13-1-4-18(25)15(9-13)19(26)24-17-3-2-14(10-16(17)21)23-11-12-5-7-22-8-6-12/h1-10,23,25H,11H2,(H,24,26).
What are the key properties of 5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide?
5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide has a molecular weight of 388.25 g/mol, XLogP of 4.96, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-chloro-4-(pyridin-4-ylmethylamino)phenyl]-2-hydroxybenzamide is sourced from PubChem (CID 162659350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).