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

C19H22Cl2N2O2 — CID 162649095

IUPAC5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide
SMILESCCCN(CCC)c1ccc(NC(=O)c2cc(Cl)ccc2O)c(Cl)c1
InChIInChI=1S/C19H22Cl2N2O2/c1-3-9-23(10-4-2)14-6-7-17(16(21)12-14)22-19(25)15-11-13(20)5-8-18(15)24/h5-8,11-12,24H,3-4,9-10H2,1-2H3,(H,22,25)
InChIKeyZQHPXKTUEROPOZ-UHFFFAOYSA-N
MW381.30 g/mol
LogP5.58
Rot. Bonds7

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

5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide (PubChem CID 162649095) has the molecular formula C19H22Cl2N2O2 and a molecular weight of 381.30 g/mol. Its IUPAC name is 5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide
PubChem CID162649095
Molecular FormulaC19H22Cl2N2O2
Molecular Weight381.30 g/mol
Exact Mass380.11
IUPAC Name5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide
SMILESCCCN(CCC)c1ccc(NC(=O)c2cc(Cl)ccc2O)c(Cl)c1
InChIInChI=1S/C19H22Cl2N2O2/c1-3-9-23(10-4-2)14-6-7-17(16(21)12-14)22-19(25)15-11-13(20)5-8-18(15)24/h5-8,11-12,24H,3-4,9-10H2,1-2H3,(H,22,25)
InChIKeyZQHPXKTUEROPOZ-UHFFFAOYSA-N
XLogP5.58
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.30
LogP ≤ 55.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide?
The IUPAC name of 5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide (CID 162649095) is 5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide.
What is the SMILES notation for 5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide?
The canonical SMILES for 5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide is CCCN(CCC)c1ccc(NC(=O)c2cc(Cl)ccc2O)c(Cl)c1.
What is the InChIKey of 5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide?
The InChIKey is ZQHPXKTUEROPOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22Cl2N2O2/c1-3-9-23(10-4-2)14-6-7-17(16(21)12-14)22-19(25)15-11-13(20)5-8-18(15)24/h5-8,11-12,24H,3-4,9-10H2,1-2H3,(H,22,25).
What are the key properties of 5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide?
5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide has a molecular weight of 381.30 g/mol, XLogP of 5.58, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-chloro-4-(dipropylamino)phenyl]-2-hydroxybenzamide is sourced from PubChem (CID 162649095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).