2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide

C22H21N3O3 — CID 113163524

IUPAC2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccccc1Oc1ccccc1)Cc1ccccn1
InChIInChI=1S/C22H21N3O3/c1-17(26)25(15-18-9-7-8-14-23-18)16-22(27)24-20-12-5-6-13-21(20)28-19-10-3-2-4-11-19/h2-14H,15-16H2,1H3,(H,24,27)
InChIKeyRLHRLSRHFRZIFZ-UHFFFAOYSA-N
MW375.43 g/mol
LogP3.86
Rot. Bonds7

About 2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide

2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide (PubChem CID 113163524) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is 2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide
PubChem CID113163524
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC Name2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccccc1Oc1ccccc1)Cc1ccccn1
InChIInChI=1S/C22H21N3O3/c1-17(26)25(15-18-9-7-8-14-23-18)16-22(27)24-20-12-5-6-13-21(20)28-19-10-3-2-4-11-19/h2-14H,15-16H2,1H3,(H,24,27)
InChIKeyRLHRLSRHFRZIFZ-UHFFFAOYSA-N
XLogP3.86
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[acetyl(pyridin-2-ylmethyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 113163489
3-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-methoxyphenyl)propanamide
CID 113120272
N-(2-phenoxyphenyl)-3-(pyridin-2-ylmethylamino)propanamide
CID 109023444
2-[acetyl(pyridin-2-ylmethyl)amino]-N-(3-chloro-4-methoxyphenyl)acetamide
CID 113163474
2-(N-acetyl-4-methylanilino)-N-(2-phenoxyphenyl)acetamide
CID 113167825
2-[acetyl(pyridin-2-ylmethyl)amino]-N-[(4-fluorophenyl)methyl]acetamide
CID 113163380
2-[acetyl(pyridin-2-ylmethyl)amino]-N-cycloheptylacetamide
CID 113163426
2-[acetyl-[(4-methoxyphenyl)methyl]amino]-N-(2-methoxyphenyl)acetamide
CID 113163139
2-[acetyl(pyridin-2-ylmethyl)amino]-N-(3-cyanophenyl)acetamide
CID 113163539
2-[methylsulfonyl(pyridin-2-ylmethyl)amino]-N-(2-propan-2-yloxyphenyl)acetamide
CID 113151528
2-[methyl(2-pyridin-4-ylethyl)amino]-N-(2-phenoxyphenyl)acetamide
CID 109001458
3-[acetyl(furan-2-ylmethyl)amino]-N-(2-phenoxyphenyl)propanamide
CID 113118157

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide?
The IUPAC name of 2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide (CID 113163524) is 2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide.
What is the SMILES notation for 2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide?
The canonical SMILES for 2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide is CC(=O)N(CC(=O)Nc1ccccc1Oc1ccccc1)Cc1ccccn1.
What is the InChIKey of 2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide?
The InChIKey is RLHRLSRHFRZIFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c1-17(26)25(15-18-9-7-8-14-23-18)16-22(27)24-20-12-5-6-13-21(20)28-19-10-3-2-4-11-19/h2-14H,15-16H2,1H3,(H,24,27).
What are the key properties of 2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide?
2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide has a molecular weight of 375.43 g/mol, XLogP of 3.86, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(pyridin-2-ylmethyl)amino]-N-(2-phenoxyphenyl)acetamide is sourced from PubChem (CID 113163524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).