3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide

C20H25NO2 — CID 112794606

IUPAC3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide
SMILESCCC(C)C(C(=O)NCCOc1ccccc1)c1ccccc1
InChIInChI=1S/C20H25NO2/c1-3-16(2)19(17-10-6-4-7-11-17)20(22)21-14-15-23-18-12-8-5-9-13-18/h4-13,16,19H,3,14-15H2,1-2H3,(H,21,22)
InChIKeyJESNWHFZWPEGRV-UHFFFAOYSA-N
MW311.43 g/mol
LogP4.01
Rot. Bonds8

About 3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide

3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide (PubChem CID 112794606) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is 3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide.

Molecular Properties

Compound Name3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide
PubChem CID112794606
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC Name3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide
SMILESCCC(C)C(C(=O)NCCOc1ccccc1)c1ccccc1
InChIInChI=1S/C20H25NO2/c1-3-16(2)19(17-10-6-4-7-11-17)20(22)21-14-15-23-18-12-8-5-9-13-18/h4-13,16,19H,3,14-15H2,1-2H3,(H,21,22)
InChIKeyJESNWHFZWPEGRV-UHFFFAOYSA-N
XLogP4.01
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.01
H-Bond Donors ≤ 51
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-(2-methoxyethylamino)ethyl]-3-methyl-2-phenylpentanamide
CID 82990815
N-(3-bromobutyl)-3-methyl-2-phenylpentanamide
CID 114312530
N-(2-phenoxyethyl)-2-sulfanylpropanamide
CID 107026809
2-bromo-N-(2-phenoxyethyl)propanamide
CID 82108617
N-but-3-enyl-3-methyl-2-phenylpentanamide
CID 113466088
2-amino-N-(2-phenoxyethyl)propanamide;hydrochloride
CID 119268582
N-(3-chloro-2-methylpropyl)-3-methyl-2-phenylpentanamide
CID 114302680
3-methoxy-N-[2-[(3-methyl-2-phenylpentanoyl)amino]ethyl]benzamide
CID 78846238
(2R)-3-methyl-N-[2-[2-[[(2S)-3-methyl-2-phenylbutanoyl]amino]ethoxy]ethyl]-2-phenylbutanamide
CID 122660054
N-(2-phenoxyethyl)-2-phenyl-2-phenylsulfanylacetamide
CID 16547374
N-[3-(furan-2-ylmethoxy)propyl]-3-methyl-2-phenylpentanamide
CID 78835063
N-(1,3-dihydroxypropan-2-yl)-3-methyl-2-phenylpentanamide
CID 65315116

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide?
The IUPAC name of 3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide (CID 112794606) is 3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide.
What is the SMILES notation for 3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide?
The canonical SMILES for 3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide is CCC(C)C(C(=O)NCCOc1ccccc1)c1ccccc1.
What is the InChIKey of 3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide?
The InChIKey is JESNWHFZWPEGRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-3-16(2)19(17-10-6-4-7-11-17)20(22)21-14-15-23-18-12-8-5-9-13-18/h4-13,16,19H,3,14-15H2,1-2H3,(H,21,22).
What are the key properties of 3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide?
3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide has a molecular weight of 311.43 g/mol, XLogP of 4.01, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-phenoxyethyl)-2-phenylpentanamide is sourced from PubChem (CID 112794606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).