1-imidazol-1-yl-1,3-diphenylpropan-2-amine

C18H19N3 — CID 16782420

IUPAC1-imidazol-1-yl-1,3-diphenylpropan-2-amine
SMILESNC(Cc1ccccc1)C(c1ccccc1)n1ccnc1
InChIInChI=1S/C18H19N3/c19-17(13-15-7-3-1-4-8-15)18(21-12-11-20-14-21)16-9-5-2-6-10-16/h1-12,14,17-18H,13,19H2
InChIKeyFNZASKVUDGTAEV-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.04
Rot. Bonds5

About 1-imidazol-1-yl-1,3-diphenylpropan-2-amine

1-imidazol-1-yl-1,3-diphenylpropan-2-amine (PubChem CID 16782420) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is 1-imidazol-1-yl-1,3-diphenylpropan-2-amine.

Molecular Properties

Compound Name1-imidazol-1-yl-1,3-diphenylpropan-2-amine
PubChem CID16782420
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC Name1-imidazol-1-yl-1,3-diphenylpropan-2-amine
SMILESNC(Cc1ccccc1)C(c1ccccc1)n1ccnc1
InChIInChI=1S/C18H19N3/c19-17(13-15-7-3-1-4-8-15)18(21-12-11-20-14-21)16-9-5-2-6-10-16/h1-12,14,17-18H,13,19H2
InChIKeyFNZASKVUDGTAEV-UHFFFAOYSA-N
XLogP3.04
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-imidazol-1-yl-1,3-diphenylpropan-2-amine?
The IUPAC name of 1-imidazol-1-yl-1,3-diphenylpropan-2-amine (CID 16782420) is 1-imidazol-1-yl-1,3-diphenylpropan-2-amine.
What is the SMILES notation for 1-imidazol-1-yl-1,3-diphenylpropan-2-amine?
The canonical SMILES for 1-imidazol-1-yl-1,3-diphenylpropan-2-amine is NC(Cc1ccccc1)C(c1ccccc1)n1ccnc1.
What is the InChIKey of 1-imidazol-1-yl-1,3-diphenylpropan-2-amine?
The InChIKey is FNZASKVUDGTAEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c19-17(13-15-7-3-1-4-8-15)18(21-12-11-20-14-21)16-9-5-2-6-10-16/h1-12,14,17-18H,13,19H2.
What are the key properties of 1-imidazol-1-yl-1,3-diphenylpropan-2-amine?
1-imidazol-1-yl-1,3-diphenylpropan-2-amine has a molecular weight of 277.37 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-imidazol-1-yl-1,3-diphenylpropan-2-amine is sourced from PubChem (CID 16782420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).