2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide

C19H23N3O3 — CID 113025408

IUPAC2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide
SMILESCc1ccc(OCC(=O)Nc2ccc(NCC3CCCO3)cn2)cc1
InChIInChI=1S/C19H23N3O3/c1-14-4-7-16(8-5-14)25-13-19(23)22-18-9-6-15(11-21-18)20-12-17-3-2-10-24-17/h4-9,11,17,20H,2-3,10,12-13H2,1H3,(H,21,22,23)
InChIKeyGRGQQQGOJIYNBP-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.00
Rot. Bonds7

About 2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide

2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide (PubChem CID 113025408) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide
PubChem CID113025408
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide
SMILESCc1ccc(OCC(=O)Nc2ccc(NCC3CCCO3)cn2)cc1
InChIInChI=1S/C19H23N3O3/c1-14-4-7-16(8-5-14)25-13-19(23)22-18-9-6-15(11-21-18)20-12-17-3-2-10-24-17/h4-9,11,17,20H,2-3,10,12-13H2,1H3,(H,21,22,23)
InChIKeyGRGQQQGOJIYNBP-UHFFFAOYSA-N
XLogP3.00
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methoxyphenyl)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide
CID 113025395
ethyl N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]carbamate
CID 113025422
3-methyl-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]butanamide
CID 113025362
N-(4-methylphenyl)-2-[4-[[[(2S)-oxolan-2-yl]methylamino]methyl]phenoxy]acetamide
CID 51991134
2-(4-methylphenoxy)-N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide
CID 17105820
2-methoxy-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]benzamide
CID 113025379
2-(4-methoxyphenyl)-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]acetamide
CID 113010614
3,4,5-trimethoxy-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]benzamide
CID 113025389
5-methyl-N-(oxolan-2-ylmethyl)pyridin-2-amine
CID 43104324
2-(4-methylphenoxy)-N-[5-[[(2R)-oxolan-2-yl]methylsulfamoyl]-1,3,4-thiadiazol-2-yl]acetamide
CID 51606970
2-(3,5-dimethylphenoxy)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 4957867
2-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]phenoxy]-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 39819010

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide?
The IUPAC name of 2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide (CID 113025408) is 2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide.
What is the SMILES notation for 2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide?
The canonical SMILES for 2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide is Cc1ccc(OCC(=O)Nc2ccc(NCC3CCCO3)cn2)cc1.
What is the InChIKey of 2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide?
The InChIKey is GRGQQQGOJIYNBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-14-4-7-16(8-5-14)25-13-19(23)22-18-9-6-15(11-21-18)20-12-17-3-2-10-24-17/h4-9,11,17,20H,2-3,10,12-13H2,1H3,(H,21,22,23).
What are the key properties of 2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide?
2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide has a molecular weight of 341.41 g/mol, XLogP of 3.00, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide is sourced from PubChem (CID 113025408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).