N-ethyl-3-phenazin-1-ylpropan-1-amine

C17H19N3 — CID 97034004

IUPACN-ethyl-3-phenazin-1-ylpropan-1-amine
SMILESCCNCCCc1cccc2nc3ccccc3nc12
InChIInChI=1S/C17H19N3/c1-2-18-12-6-8-13-7-5-11-16-17(13)20-15-10-4-3-9-14(15)19-16/h3-5,7,9-11,18H,2,6,8,12H2,1H3
InChIKeyQCYBSGXOOUZMNO-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.33
Rot. Bonds5

About N-ethyl-3-phenazin-1-ylpropan-1-amine

N-ethyl-3-phenazin-1-ylpropan-1-amine (PubChem CID 97034004) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-ethyl-3-phenazin-1-ylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-phenazin-1-ylpropan-1-amine
PubChem CID97034004
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC NameN-ethyl-3-phenazin-1-ylpropan-1-amine
SMILESCCNCCCc1cccc2nc3ccccc3nc12
InChIInChI=1S/C17H19N3/c1-2-18-12-6-8-13-7-5-11-16-17(13)20-15-10-4-3-9-14(15)19-16/h3-5,7,9-11,18H,2,6,8,12H2,1H3
InChIKeyQCYBSGXOOUZMNO-UHFFFAOYSA-N
XLogP3.33
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

1-heptylphenazine;hydrochloride
CID 175352325
4-propylacridine
CID 609894
3-(2-azidophenyl)-N-ethylpropan-1-amine
CID 11790330
N-ethyl-17-phenylheptadecan-1-amine
CID 139804977
N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine
CID 65305418
N-ethyl-3-pyridin-2-ylpropan-1-amine
CID 59134802
4-(4-chloronaphthalen-1-yl)-N-ethylbutan-1-amine
CID 79597058
[6-(hydroxymethyl)phenazin-1-yl]methanol
CID 44607162
1-octadecylacridine
CID 87175858
N-ethyl-6-(4-fluoronaphthalen-1-yl)hexan-1-amine
CID 65306558
N-ethyl-3-(4-methyl-3-pyridinyl)propan-1-amine
CID 66272322
2-nitro-1-(2-phenazin-1-ylethyl)phenazine
CID 53440321

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-phenazin-1-ylpropan-1-amine?
The IUPAC name of N-ethyl-3-phenazin-1-ylpropan-1-amine (CID 97034004) is N-ethyl-3-phenazin-1-ylpropan-1-amine.
What is the SMILES notation for N-ethyl-3-phenazin-1-ylpropan-1-amine?
The canonical SMILES for N-ethyl-3-phenazin-1-ylpropan-1-amine is CCNCCCc1cccc2nc3ccccc3nc12.
What is the InChIKey of N-ethyl-3-phenazin-1-ylpropan-1-amine?
The InChIKey is QCYBSGXOOUZMNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-2-18-12-6-8-13-7-5-11-16-17(13)20-15-10-4-3-9-14(15)19-16/h3-5,7,9-11,18H,2,6,8,12H2,1H3.
What are the key properties of N-ethyl-3-phenazin-1-ylpropan-1-amine?
N-ethyl-3-phenazin-1-ylpropan-1-amine has a molecular weight of 265.36 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-phenazin-1-ylpropan-1-amine is sourced from PubChem (CID 97034004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).