N-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide

C24H24NO3- — CID 21281069

IUPACN-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide
SMILESCC(Cc1ccccc1)N([O-])C(=O)Cc1cccc(OCc2ccccc2)c1
InChIInChI=1S/C24H24NO3/c1-19(15-20-9-4-2-5-10-20)25(27)24(26)17-22-13-8-14-23(16-22)28-18-21-11-6-3-7-12-21/h2-14,16,19H,15,17-18H2,1H3/q-1
InChIKeyAJUJVQYGCDPUPD-UHFFFAOYSA-N
MW374.46 g/mol
LogP4.77
Rot. Bonds8

About N-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide

N-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide (PubChem CID 21281069) has the molecular formula C24H24NO3- and a molecular weight of 374.46 g/mol. Its IUPAC name is N-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide.

Molecular Properties

Compound NameN-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide
PubChem CID21281069
Molecular FormulaC24H24NO3-
Molecular Weight374.46 g/mol
Exact Mass374.18
IUPAC NameN-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide
SMILESCC(Cc1ccccc1)N([O-])C(=O)Cc1cccc(OCc2ccccc2)c1
InChIInChI=1S/C24H24NO3/c1-19(15-20-9-4-2-5-10-20)25(27)24(26)17-22-13-8-14-23(16-22)28-18-21-11-6-3-7-12-21/h2-14,16,19H,15,17-18H2,1H3/q-1
InChIKeyAJUJVQYGCDPUPD-UHFFFAOYSA-N
XLogP4.77
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(3-phenylmethoxyphenyl)methyl]pentanoic acid
CID 84752879
ethyl (E)-3-hydroxy-2-[(3-phenylmethoxyphenyl)methyl]prop-2-enoate
CID 10543118
1-(1-ethoxyethoxy)-3-phenylmethoxybenzene
CID 22345861
tert-butyl N-oxido-N-(1-phenylpropan-2-yl)carbamate
CID 87963994
(2R)-2-[(3-phenylmethoxyphenyl)methylamino]propanoic acid
CID 95003342
3,5-bis(3-phenylmethoxyphenyl)heptan-4-one
CID 139719265
(3-phenylmethoxyphenyl) (2S)-2-aminopropanoate
CID 67767154
2-(3-ethoxyphenyl)acetyl chloride
CID 22994163
2-[4-[(3-ethoxyphenoxy)methyl]phenyl]acetic acid
CID 105344950
1-phenylmethoxy-3-propylbenzene
CID 58977798
2-methyl-6-[(3-phenylmethoxyphenoxy)methyl]benzoic acid
CID 22241425
N-(1-hydroxypropan-2-yl)-2-(3-methoxyphenyl)-N-methylacetamide
CID 113337596

Frequently Asked Questions

What is the IUPAC name of N-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide?
The IUPAC name of N-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide (CID 21281069) is N-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide.
What is the SMILES notation for N-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide?
The canonical SMILES for N-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide is CC(Cc1ccccc1)N([O-])C(=O)Cc1cccc(OCc2ccccc2)c1.
What is the InChIKey of N-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide?
The InChIKey is AJUJVQYGCDPUPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24NO3/c1-19(15-20-9-4-2-5-10-20)25(27)24(26)17-22-13-8-14-23(16-22)28-18-21-11-6-3-7-12-21/h2-14,16,19H,15,17-18H2,1H3/q-1.
What are the key properties of N-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide?
N-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide has a molecular weight of 374.46 g/mol, XLogP of 4.77, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-oxido-2-(3-phenylmethoxyphenyl)-N-(1-phenylpropan-2-yl)acetamide is sourced from PubChem (CID 21281069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).