2-amino-4-phenyl-N-phenylmethoxybutanamide

C17H20N2O2 — CID 76637297

IUPAC2-amino-4-phenyl-N-phenylmethoxybutanamide
SMILESNC(CCc1ccccc1)C(=O)NOCc1ccccc1
InChIInChI=1S/C17H20N2O2/c18-16(12-11-14-7-3-1-4-8-14)17(20)19-21-13-15-9-5-2-6-10-15/h1-10,16H,11-13,18H2,(H,19,20)
InChIKeyXAXZMAHWKRPIKF-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.19
Rot. Bonds7

About 2-amino-4-phenyl-N-phenylmethoxybutanamide

2-amino-4-phenyl-N-phenylmethoxybutanamide (PubChem CID 76637297) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-amino-4-phenyl-N-phenylmethoxybutanamide.

Molecular Properties

Compound Name2-amino-4-phenyl-N-phenylmethoxybutanamide
PubChem CID76637297
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-amino-4-phenyl-N-phenylmethoxybutanamide
SMILESNC(CCc1ccccc1)C(=O)NOCc1ccccc1
InChIInChI=1S/C17H20N2O2/c18-16(12-11-14-7-3-1-4-8-14)17(20)19-21-13-15-9-5-2-6-10-15/h1-10,16H,11-13,18H2,(H,19,20)
InChIKeyXAXZMAHWKRPIKF-UHFFFAOYSA-N
XLogP2.19
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2R)-2-amino-N-phenylmethoxypropanamide
CID 54406296
(2S)-2-amino-5-(carbamoylamino)-N-phenylmethoxypentanamide
CID 141443223
2-amino-2-phenyl-N-phenylmethoxyacetamide
CID 64974988
methyl (2S)-2-amino-4-phenylbutanoate
CID 10867190
(2S)-2-amino-4-phenylbutanoic acid;bohrium
CID 59366799
2-amino-4-phenyl-N-propan-2-ylbutanamide
CID 114924577
acetic acid;methyl (2S)-2-amino-4-phenylbutanoate
CID 170899372
2-amino-3-methyl-N-phenylmethoxypentanamide
CID 64974779
2-hydroxy-5-methyl-N-phenylmethoxyhexanamide
CID 174417075
methyl (2S)-2-[[(2R)-2-amino-4-phenylbutanoyl]amino]-3-phenylpropanoate
CID 10807081
(2S)-2-amino-N-[(3S)-2-oxo-5-phenyl-1-phenylmethoxypentan-3-yl]-4-phenylbutanamide;hydrochloride
CID 23551238
2,3,4-trihydroxy-N-phenylmethoxybutanamide
CID 130149986

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-phenyl-N-phenylmethoxybutanamide?
The IUPAC name of 2-amino-4-phenyl-N-phenylmethoxybutanamide (CID 76637297) is 2-amino-4-phenyl-N-phenylmethoxybutanamide.
What is the SMILES notation for 2-amino-4-phenyl-N-phenylmethoxybutanamide?
The canonical SMILES for 2-amino-4-phenyl-N-phenylmethoxybutanamide is NC(CCc1ccccc1)C(=O)NOCc1ccccc1.
What is the InChIKey of 2-amino-4-phenyl-N-phenylmethoxybutanamide?
The InChIKey is XAXZMAHWKRPIKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c18-16(12-11-14-7-3-1-4-8-14)17(20)19-21-13-15-9-5-2-6-10-15/h1-10,16H,11-13,18H2,(H,19,20).
What are the key properties of 2-amino-4-phenyl-N-phenylmethoxybutanamide?
2-amino-4-phenyl-N-phenylmethoxybutanamide has a molecular weight of 284.36 g/mol, XLogP of 2.19, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-phenyl-N-phenylmethoxybutanamide is sourced from PubChem (CID 76637297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).