N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide

C18H14Cl2N4O — CID 109171976

IUPACN-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1Cl)c1ccnc(NCc2cccnc2)c1
InChIInChI=1S/C18H14Cl2N4O/c19-14-3-4-15(20)16(9-14)24-18(25)13-5-7-22-17(8-13)23-11-12-2-1-6-21-10-12/h1-10H,11H2,(H,22,23)(H,24,25)
InChIKeyFLEMVOXCWRKNJW-UHFFFAOYSA-N
MW373.24 g/mol
LogP4.65
Rot. Bonds5

About N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide

N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide (PubChem CID 109171976) has the molecular formula C18H14Cl2N4O and a molecular weight of 373.24 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
PubChem CID109171976
Molecular FormulaC18H14Cl2N4O
Molecular Weight373.24 g/mol
Exact Mass372.05
IUPAC NameN-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1Cl)c1ccnc(NCc2cccnc2)c1
InChIInChI=1S/C18H14Cl2N4O/c19-14-3-4-15(20)16(9-14)24-18(25)13-5-7-22-17(8-13)23-11-12-2-1-6-21-10-12/h1-10H,11H2,(H,22,23)(H,24,25)
InChIKeyFLEMVOXCWRKNJW-UHFFFAOYSA-N
XLogP4.65
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.24
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,6-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
CID 109171978
N-(2-bromophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
CID 109171963
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
CID 109171981
N-(2,4-dichlorophenyl)-6-(pyridin-3-ylmethylamino)pyridine-3-carboxamide
CID 109157918
N-[2-(3-chlorophenyl)ethyl]-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
CID 109171926
N-(4-bromo-2-methylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
CID 109171966
2-(pyridin-3-ylmethylamino)pyridine-4-carboxylic acid
CID 29037275
6-(benzylamino)-N-(2,5-dichlorophenyl)pyridine-3-carboxamide
CID 109155556
N-(2-chlorophenyl)-6-(pyridin-3-ylmethylamino)pyrimidine-4-carboxamide
CID 109349914
N-(5-chloro-2-methylphenyl)-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide
CID 109121014
2-[(4-chlorophenyl)methylamino]-N-(2-fluorophenyl)pyridine-4-carboxamide
CID 109170960
N-(2-morpholin-4-ylphenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide
CID 109171960

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide?
The IUPAC name of N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide (CID 109171976) is N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide is O=C(Nc1cc(Cl)ccc1Cl)c1ccnc(NCc2cccnc2)c1.
What is the InChIKey of N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide?
The InChIKey is FLEMVOXCWRKNJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Cl2N4O/c19-14-3-4-15(20)16(9-14)24-18(25)13-5-7-22-17(8-13)23-11-12-2-1-6-21-10-12/h1-10H,11H2,(H,22,23)(H,24,25).
What are the key properties of N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide?
N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide has a molecular weight of 373.24 g/mol, XLogP of 4.65, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-2-(pyridin-3-ylmethylamino)pyridine-4-carboxamide is sourced from PubChem (CID 109171976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).