N-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide

C17H20N2O — CID 28684450

IUPACN-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide
SMILESCC(=O)NCCNCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H20N2O/c1-14(20)19-12-11-18-13-15-7-9-17(10-8-15)16-5-3-2-4-6-16/h2-10,18H,11-13H2,1H3,(H,19,20)
InChIKeyKEDDNQMCHPZVDG-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.58
Rot. Bonds6

About N-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide

N-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide (PubChem CID 28684450) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is N-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide
PubChem CID28684450
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC NameN-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide
SMILESCC(=O)NCCNCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H20N2O/c1-14(20)19-12-11-18-13-15-7-9-17(10-8-15)16-5-3-2-4-6-16/h2-10,18H,11-13H2,1H3,(H,19,20)
InChIKeyKEDDNQMCHPZVDG-UHFFFAOYSA-N
XLogP2.58
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[[4-(2-phenylethyl)phenyl]methylamino]ethyl]acetamide
CID 11437928
N-[2-[(4-bromophenyl)methylamino]ethyl]acetamide
CID 28684406
N-[2-(4-phenylanilino)ethyl]acetamide
CID 103604100
N,N'-bis[(4-phenylphenyl)methyl]butane-1,4-diamine
CID 10273675
N-[2-[(4-propan-2-yloxyphenyl)methylamino]ethyl]acetamide
CID 43770338
N-[2-(benzylamino)ethyl]propanamide
CID 54513126
4-amino-N-[2-[(4-phenylphenyl)methylamino]ethyl]-1,2,5-oxadiazol-5-ium-3-carboxamide chloride
CID 135942024
2-ethylsulfonyl-N-[(4-phenylphenyl)methyl]ethanamine
CID 103643079
N-[2-[(3-chlorophenyl)methylamino]ethyl]acetamide
CID 28710214
4-(acetamidomethyl)-N-(4-phenylphenyl)benzamide
CID 78805930
2-chloro-N-[[4-(4-phenylphenyl)phenyl]methyl]acetamide
CID 146595387
N-(3-acetamidopropyl)-4-phenylbenzamide
CID 38450168

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide?
The IUPAC name of N-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide (CID 28684450) is N-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide.
What is the SMILES notation for N-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide?
The canonical SMILES for N-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide is CC(=O)NCCNCc1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide?
The InChIKey is KEDDNQMCHPZVDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-14(20)19-12-11-18-13-15-7-9-17(10-8-15)16-5-3-2-4-6-16/h2-10,18H,11-13H2,1H3,(H,19,20).
What are the key properties of N-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide?
N-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide has a molecular weight of 268.36 g/mol, XLogP of 2.58, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-phenylphenyl)methylamino]ethyl]acetamide is sourced from PubChem (CID 28684450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).