N-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide

C17H20N2O2 — CID 13242827

IUPACN-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide
SMILESNC(Cc1ccccc1)CN(C=O)OCc1ccccc1
InChIInChI=1S/C17H20N2O2/c18-17(11-15-7-3-1-4-8-15)12-19(14-20)21-13-16-9-5-2-6-10-16/h1-10,14,17H,11-13,18H2
InChIKeyJADGUJXFWTUGOM-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.15
Rot. Bonds8

About N-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide

N-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide (PubChem CID 13242827) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide.

Molecular Properties

Compound NameN-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide
PubChem CID13242827
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide
SMILESNC(Cc1ccccc1)CN(C=O)OCc1ccccc1
InChIInChI=1S/C17H20N2O2/c18-17(11-15-7-3-1-4-8-15)12-19(14-20)21-13-16-9-5-2-6-10-16/h1-10,14,17H,11-13,18H2
InChIKeyJADGUJXFWTUGOM-UHFFFAOYSA-N
XLogP2.15
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.15
H-Bond Donors ≤ 51
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-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide?
The IUPAC name of N-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide (CID 13242827) is N-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide.
What is the SMILES notation for N-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide?
The canonical SMILES for N-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide is NC(Cc1ccccc1)CN(C=O)OCc1ccccc1.
What is the InChIKey of N-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide?
The InChIKey is JADGUJXFWTUGOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c18-17(11-15-7-3-1-4-8-15)12-19(14-20)21-13-16-9-5-2-6-10-16/h1-10,14,17H,11-13,18H2.
What are the key properties of N-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide?
N-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide has a molecular weight of 284.36 g/mol, XLogP of 2.15, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-3-phenylpropyl)-N-phenylmethoxyformamide is sourced from PubChem (CID 13242827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).