N-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide

C22H22N2O3 — CID 110632945

IUPACN-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide
SMILESO=C(NOCCOc1ccccc1)C(Cc1cccnc1)c1ccccc1
InChIInChI=1S/C22H22N2O3/c25-22(24-27-15-14-26-20-11-5-2-6-12-20)21(19-9-3-1-4-10-19)16-18-8-7-13-23-17-18/h1-13,17,21H,14-16H2,(H,24,25)
InChIKeyAHUQIPVRRVRWOR-UHFFFAOYSA-N
MW362.43 g/mol
LogP3.53
Rot. Bonds9

About N-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide

N-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide (PubChem CID 110632945) has the molecular formula C22H22N2O3 and a molecular weight of 362.43 g/mol. Its IUPAC name is N-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide
PubChem CID110632945
Molecular FormulaC22H22N2O3
Molecular Weight362.43 g/mol
Exact Mass362.16
IUPAC NameN-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide
SMILESO=C(NOCCOc1ccccc1)C(Cc1cccnc1)c1ccccc1
InChIInChI=1S/C22H22N2O3/c25-22(24-27-15-14-26-20-11-5-2-6-12-20)21(19-9-3-1-4-10-19)16-18-8-7-13-23-17-18/h1-13,17,21H,14-16H2,(H,24,25)
InChIKeyAHUQIPVRRVRWOR-UHFFFAOYSA-N
XLogP3.53
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-phenyl-3-pyridin-3-ylpropanamide
CID 171502842
N-(4-methoxybutyl)-2-phenyl-3-pyridin-3-ylpropanamide
CID 110610135
N-[(4-methylphenyl)methyl]-2-phenyl-3-pyridin-3-ylpropanamide
CID 110409246
N-[(4-fluorophenyl)methyl]-2-phenyl-3-pyridin-3-ylpropanamide
CID 110409718
N-[2-[4-(dimethylamino)phenyl]ethyl]-2-phenyl-3-pyridin-3-ylpropanamide
CID 110627067
N-(2,5-dimethoxyphenyl)-2-phenyl-3-pyridin-3-ylpropanamide
CID 110422839
N-(3-fluorophenyl)-2-phenyl-3-pyridin-3-ylpropanamide
CID 110425726
N-(2-phenoxyethoxy)-2-phenylacetamide
CID 110294668
2-methyl-1-phenyl-3-pyridin-3-ylpropan-1-one
CID 104845055
N-[4-(cyclopropanecarbonyl)phenyl]-2-phenyl-3-pyridin-3-ylpropanamide
CID 110425839
N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]-2-phenyl-3-pyridin-3-ylpropanamide
CID 110632380
3-phenyl-2-pyridin-3-ylpropanoic acid;hydrochloride
CID 175333059

Frequently Asked Questions

What is the IUPAC name of N-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide?
The IUPAC name of N-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide (CID 110632945) is N-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide is O=C(NOCCOc1ccccc1)C(Cc1cccnc1)c1ccccc1.
What is the InChIKey of N-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide?
The InChIKey is AHUQIPVRRVRWOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O3/c25-22(24-27-15-14-26-20-11-5-2-6-12-20)21(19-9-3-1-4-10-19)16-18-8-7-13-23-17-18/h1-13,17,21H,14-16H2,(H,24,25).
What are the key properties of N-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide?
N-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide has a molecular weight of 362.43 g/mol, XLogP of 3.53, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenoxyethoxy)-2-phenyl-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 110632945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).