2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide

C14H13Cl2N3O — CID 62153413

IUPAC2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide
SMILESNc1cc(C(=O)NCCc2ccc(Cl)cc2Cl)ccn1
InChIInChI=1S/C14H13Cl2N3O/c15-11-2-1-9(12(16)8-11)3-6-19-14(20)10-4-5-18-13(17)7-10/h1-2,4-5,7-8H,3,6H2,(H2,17,18)(H,19,20)
InChIKeyRTLZGJUSTLYCJH-UHFFFAOYSA-N
MW310.18 g/mol
LogP2.94
Rot. Bonds4

About 2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide

2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide (PubChem CID 62153413) has the molecular formula C14H13Cl2N3O and a molecular weight of 310.18 g/mol. Its IUPAC name is 2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide
PubChem CID62153413
Molecular FormulaC14H13Cl2N3O
Molecular Weight310.18 g/mol
Exact Mass309.04
IUPAC Name2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide
SMILESNc1cc(C(=O)NCCc2ccc(Cl)cc2Cl)ccn1
InChIInChI=1S/C14H13Cl2N3O/c15-11-2-1-9(12(16)8-11)3-6-19-14(20)10-4-5-18-13(17)7-10/h1-2,4-5,7-8H,3,6H2,(H2,17,18)(H,19,20)
InChIKeyRTLZGJUSTLYCJH-UHFFFAOYSA-N
XLogP2.94
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.18
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-[2-(2,4-dichlorophenyl)ethyl]-2-N,2-N-diethylpyridine-2,4-dicarboxamide
CID 109088909
N-[2-(2,4-dichlorophenyl)ethyl]pyridine-3-carboxamide
CID 17472910
3-amino-N-[2-(2,4-dichlorophenyl)ethyl]-1H-pyrazole-5-carboxamide
CID 64525006
4-bromo-3-chloro-N-[2-(2,4-dichlorophenyl)ethyl]benzamide
CID 81295924
2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]pyridine-4-carboxamide
CID 106050315
N-[2-(2,4-dichlorophenyl)ethyl]-3-hydroxy-4-methylbenzamide
CID 29051396
N-[2-(2,4-dichlorophenyl)ethyl]-5,6-dimethylpyridine-3-carboxamide
CID 73388060
5-amino-2-chloro-N-[2-(2,4-dichlorophenyl)ethyl]benzamide
CID 29286863
N-[2-(2,4-dichlorophenyl)ethyl]-1,3-thiazole-2-carboxamide
CID 110695986
2-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 106262018
2-amino-N-[3,3-bis(3-chlorophenyl)propyl]pyridine-4-carboxamide
CID 58768975
5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-2-methylpyridine-3-carboxamide
CID 61038721

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide?
The IUPAC name of 2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide (CID 62153413) is 2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide is Nc1cc(C(=O)NCCc2ccc(Cl)cc2Cl)ccn1.
What is the InChIKey of 2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide?
The InChIKey is RTLZGJUSTLYCJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2N3O/c15-11-2-1-9(12(16)8-11)3-6-19-14(20)10-4-5-18-13(17)7-10/h1-2,4-5,7-8H,3,6H2,(H2,17,18)(H,19,20).
What are the key properties of 2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide?
2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide has a molecular weight of 310.18 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pyridine-4-carboxamide is sourced from PubChem (CID 62153413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).