3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine

C19H20Cl2N4 — CID 24785482

IUPAC3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine
SMILESCCCn1c(-c2cnc(Nc3ccc(Cl)cc3)c(Cl)c2)nc(C)c1C
InChIInChI=1S/C19H20Cl2N4/c1-4-9-25-13(3)12(2)23-19(25)14-10-17(21)18(22-11-14)24-16-7-5-15(20)6-8-16/h5-8,10-11H,4,9H2,1-3H3,(H,22,24)
InChIKeyMHNVIGLBIPNJGZ-UHFFFAOYSA-N
MW375.30 g/mol
LogP6.02
Rot. Bonds5

About 3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine

3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine (PubChem CID 24785482) has the molecular formula C19H20Cl2N4 and a molecular weight of 375.30 g/mol. Its IUPAC name is 3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine
PubChem CID24785482
Molecular FormulaC19H20Cl2N4
Molecular Weight375.30 g/mol
Exact Mass374.11
IUPAC Name3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine
SMILESCCCn1c(-c2cnc(Nc3ccc(Cl)cc3)c(Cl)c2)nc(C)c1C
InChIInChI=1S/C19H20Cl2N4/c1-4-9-25-13(3)12(2)23-19(25)14-10-17(21)18(22-11-14)24-16-7-5-15(20)6-8-16/h5-8,10-11H,4,9H2,1-3H3,(H,22,24)
InChIKeyMHNVIGLBIPNJGZ-UHFFFAOYSA-N
XLogP6.02
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.30
LogP ≤ 56.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine?
The IUPAC name of 3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine (CID 24785482) is 3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine.
What is the SMILES notation for 3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine?
The canonical SMILES for 3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine is CCCn1c(-c2cnc(Nc3ccc(Cl)cc3)c(Cl)c2)nc(C)c1C.
What is the InChIKey of 3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine?
The InChIKey is MHNVIGLBIPNJGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N4/c1-4-9-25-13(3)12(2)23-19(25)14-10-17(21)18(22-11-14)24-16-7-5-15(20)6-8-16/h5-8,10-11H,4,9H2,1-3H3,(H,22,24).
What are the key properties of 3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine?
3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine has a molecular weight of 375.30 g/mol, XLogP of 6.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(4-chlorophenyl)-5-(4,5-dimethyl-1-propylimidazol-2-yl)pyridin-2-amine is sourced from PubChem (CID 24785482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).