2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide

C14H13Cl2N3O — CID 108999324

IUPAC2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide
SMILESO=C(CNc1ccc(Cl)cc1Cl)NCc1ccccn1
InChIInChI=1S/C14H13Cl2N3O/c15-10-4-5-13(12(16)7-10)18-9-14(20)19-8-11-3-1-2-6-17-11/h1-7,18H,8-9H2,(H,19,20)
InChIKeyZCXFHQBZVKIBGS-UHFFFAOYSA-N
MW310.18 g/mol
LogP3.12
Rot. Bonds5

About 2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide

2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 108999324) has the molecular formula C14H13Cl2N3O and a molecular weight of 310.18 g/mol. Its IUPAC name is 2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide
PubChem CID108999324
Molecular FormulaC14H13Cl2N3O
Molecular Weight310.18 g/mol
Exact Mass309.04
IUPAC Name2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide
SMILESO=C(CNc1ccc(Cl)cc1Cl)NCc1ccccn1
InChIInChI=1S/C14H13Cl2N3O/c15-10-4-5-13(12(16)7-10)18-9-14(20)19-8-11-3-1-2-6-17-11/h1-7,18H,8-9H2,(H,19,20)
InChIKeyZCXFHQBZVKIBGS-UHFFFAOYSA-N
XLogP3.12
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.18
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)oxamide
CID 108502784
N'-(2,5-dichlorophenyl)-N-(pyridin-2-ylmethyl)propanediamide
CID 108947580
2-(3,4-difluoroanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999339
2-(2-tert-butylanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999257
2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999248
1-N-(2,4-dichlorophenyl)-2-N-(pyridin-2-ylmethyl)cyclopropane-1,2-dicarboxamide
CID 109136999
2-(4-chloro-2-methylphenyl)-N-(pyridin-2-ylmethyl)acetamide
CID 67968189
2-(2-methoxy-5-methylanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999277
N-(2,4-dichlorophenyl)-6-(pyridin-2-ylmethylamino)pyridazine-3-carboxamide
CID 109120780
2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide
CID 54811499
2-(2-propan-2-yloxyanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999278
2-[(4-chlorophenyl)sulfonylmethylamino]-N-(pyridin-2-ylmethyl)acetamide
CID 22300039

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide (CID 108999324) is 2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide is O=C(CNc1ccc(Cl)cc1Cl)NCc1ccccn1.
What is the InChIKey of 2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is ZCXFHQBZVKIBGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2N3O/c15-10-4-5-13(12(16)7-10)18-9-14(20)19-8-11-3-1-2-6-17-11/h1-7,18H,8-9H2,(H,19,20).
What are the key properties of 2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide?
2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 310.18 g/mol, XLogP of 3.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichloroanilino)-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 108999324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).