N-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide

C23H24N2O2 — CID 109034597

IUPACN-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide
SMILESCN(C(=O)CCNc1ccc(OCc2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C23H24N2O2/c1-25(21-10-6-3-7-11-21)23(26)16-17-24-20-12-14-22(15-13-20)27-18-19-8-4-2-5-9-19/h2-15,24H,16-18H2,1H3
InChIKeyQJYUYUKVHGEQLY-UHFFFAOYSA-N
MW360.46 g/mol
LogP4.73
Rot. Bonds8

About N-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide

N-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide (PubChem CID 109034597) has the molecular formula C23H24N2O2 and a molecular weight of 360.46 g/mol. Its IUPAC name is N-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide.

Molecular Properties

Compound NameN-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide
PubChem CID109034597
Molecular FormulaC23H24N2O2
Molecular Weight360.46 g/mol
Exact Mass360.18
IUPAC NameN-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide
SMILESCN(C(=O)CCNc1ccc(OCc2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C23H24N2O2/c1-25(21-10-6-3-7-11-21)23(26)16-17-24-20-12-14-22(15-13-20)27-18-19-8-4-2-5-9-19/h2-15,24H,16-18H2,1H3
InChIKeyQJYUYUKVHGEQLY-UHFFFAOYSA-N
XLogP4.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxyethyl)-3-(4-phenylmethoxyanilino)propanamide
CID 109015111
N-butyl-3-(4-phenylmethoxyanilino)propanamide
CID 109012323
N',N'-dimethyl-N-(4-phenylmethoxyphenyl)ethane-1,2-diamine
CID 82096405
[2-(N-methylanilino)-2-oxoethyl] 2-(4-phenylmethoxyphenoxy)acetate
CID 9139029
N-[4-[acetyl(methyl)amino]phenyl]-2-(4-phenylmethoxyanilino)acetamide
CID 54821839
3-(4-fluoroanilino)-N-(4-phenylmethoxyphenyl)propanamide
CID 109037756
N-(4-acetylphenyl)-3-(4-phenylmethoxyanilino)propanamide
CID 109041002
2-cyano-N-methyl-N-(4-phenylmethoxyphenyl)acetamide
CID 99824506
3-(4-phenylmethoxyanilino)-N-(pyridin-4-ylmethyl)propanamide
CID 109023893
tert-butyl N-[2-(4-phenylmethoxyanilino)ethyl]carbamate
CID 54527689
N-benzyl-N-methyl-3-(4-phenoxyanilino)propanamide
CID 109020512
2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide
CID 109010303

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide?
The IUPAC name of N-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide (CID 109034597) is N-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide.
What is the SMILES notation for N-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide?
The canonical SMILES for N-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide is CN(C(=O)CCNc1ccc(OCc2ccccc2)cc1)c1ccccc1.
What is the InChIKey of N-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide?
The InChIKey is QJYUYUKVHGEQLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O2/c1-25(21-10-6-3-7-11-21)23(26)16-17-24-20-12-14-22(15-13-20)27-18-19-8-4-2-5-9-19/h2-15,24H,16-18H2,1H3.
What are the key properties of N-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide?
N-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide has a molecular weight of 360.46 g/mol, XLogP of 4.73, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenyl-3-(4-phenylmethoxyanilino)propanamide is sourced from PubChem (CID 109034597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).