N-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide

C17H20N2O2 — CID 54263107

IUPACN-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide
SMILESO=CNCC(Cc1ccccc1)NOCc1ccccc1
InChIInChI=1S/C17H20N2O2/c20-14-18-12-17(11-15-7-3-1-4-8-15)19-21-13-16-9-5-2-6-10-16/h1-10,14,17,19H,11-13H2,(H,18,20)
InChIKeyREWSXBVLHGFLLS-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.07
Rot. Bonds9

About N-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide

N-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide (PubChem CID 54263107) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide.

Molecular Properties

Compound NameN-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide
PubChem CID54263107
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide
SMILESO=CNCC(Cc1ccccc1)NOCc1ccccc1
InChIInChI=1S/C17H20N2O2/c20-14-18-12-17(11-15-7-3-1-4-8-15)19-21-13-16-9-5-2-6-10-16/h1-10,14,17,19H,11-13H2,(H,18,20)
InChIKeyREWSXBVLHGFLLS-UHFFFAOYSA-N
XLogP2.07
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide?
The IUPAC name of N-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide (CID 54263107) is N-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide.
What is the SMILES notation for N-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide?
The canonical SMILES for N-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide is O=CNCC(Cc1ccccc1)NOCc1ccccc1.
What is the InChIKey of N-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide?
The InChIKey is REWSXBVLHGFLLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c20-14-18-12-17(11-15-7-3-1-4-8-15)19-21-13-16-9-5-2-6-10-16/h1-10,14,17,19H,11-13H2,(H,18,20).
What are the key properties of N-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide?
N-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide has a molecular weight of 284.36 g/mol, XLogP of 2.07, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-phenyl-2-(phenylmethoxyamino)propyl]formamide is sourced from PubChem (CID 54263107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).