N,1-diphenyl-2H-azet-4-amine;hydrochloride

C15H15ClN2 — CID 141186204

IUPACN,1-diphenyl-2H-azet-4-amine;hydrochloride
SMILESC1=C(Nc2ccccc2)N(c2ccccc2)C1.Cl
InChIInChI=1S/C15H14N2.ClH/c1-3-7-13(8-4-1)16-15-11-12-17(15)14-9-5-2-6-10-14;/h1-11,16H,12H2;1H
InChIKeyQIQWEMGDMFSLPG-UHFFFAOYSA-N
MW258.75 g/mol
LogP3.88
Rot. Bonds3

About N,1-diphenyl-2H-azet-4-amine;hydrochloride

N,1-diphenyl-2H-azet-4-amine;hydrochloride (PubChem CID 141186204) has the molecular formula C15H15ClN2 and a molecular weight of 258.75 g/mol. Its IUPAC name is N,1-diphenyl-2H-azet-4-amine;hydrochloride.

Molecular Properties

Compound NameN,1-diphenyl-2H-azet-4-amine;hydrochloride
PubChem CID141186204
Molecular FormulaC15H15ClN2
Molecular Weight258.75 g/mol
Exact Mass258.09
IUPAC NameN,1-diphenyl-2H-azet-4-amine;hydrochloride
SMILESC1=C(Nc2ccccc2)N(c2ccccc2)C1.Cl
InChIInChI=1S/C15H14N2.ClH/c1-3-7-13(8-4-1)16-15-11-12-17(15)14-9-5-2-6-10-14;/h1-11,16H,12H2;1H
InChIKeyQIQWEMGDMFSLPG-UHFFFAOYSA-N
XLogP3.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.75
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,1-diphenyl-2H-azet-4-amine;hydrochloride?
The IUPAC name of N,1-diphenyl-2H-azet-4-amine;hydrochloride (CID 141186204) is N,1-diphenyl-2H-azet-4-amine;hydrochloride.
What is the SMILES notation for N,1-diphenyl-2H-azet-4-amine;hydrochloride?
The canonical SMILES for N,1-diphenyl-2H-azet-4-amine;hydrochloride is C1=C(Nc2ccccc2)N(c2ccccc2)C1.Cl.
What is the InChIKey of N,1-diphenyl-2H-azet-4-amine;hydrochloride?
The InChIKey is QIQWEMGDMFSLPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2.ClH/c1-3-7-13(8-4-1)16-15-11-12-17(15)14-9-5-2-6-10-14;/h1-11,16H,12H2;1H.
What are the key properties of N,1-diphenyl-2H-azet-4-amine;hydrochloride?
N,1-diphenyl-2H-azet-4-amine;hydrochloride has a molecular weight of 258.75 g/mol, XLogP of 3.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-diphenyl-2H-azet-4-amine;hydrochloride is sourced from PubChem (CID 141186204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).