2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine

C20H23N3 — CID 10447834

IUPAC2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine
SMILESNCCc1cnc(CCC(c2ccccc2)c2ccccc2)[nH]1
InChIInChI=1S/C20H23N3/c21-14-13-18-15-22-20(23-18)12-11-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,15,19H,11-14,21H2,(H,22,23)
InChIKeyBPZGZNLONLANFE-UHFFFAOYSA-N
MW305.43 g/mol
LogP3.68
Rot. Bonds7

About 2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine

2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine (PubChem CID 10447834) has the molecular formula C20H23N3 and a molecular weight of 305.43 g/mol. Its IUPAC name is 2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine
PubChem CID10447834
Molecular FormulaC20H23N3
Molecular Weight305.43 g/mol
Exact Mass305.19
IUPAC Name2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine
SMILESNCCc1cnc(CCC(c2ccccc2)c2ccccc2)[nH]1
InChIInChI=1S/C20H23N3/c21-14-13-18-15-22-20(23-18)12-11-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,15,19H,11-14,21H2,(H,22,23)
InChIKeyBPZGZNLONLANFE-UHFFFAOYSA-N
XLogP3.68
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine?
The IUPAC name of 2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine (CID 10447834) is 2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine.
What is the SMILES notation for 2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine?
The canonical SMILES for 2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine is NCCc1cnc(CCC(c2ccccc2)c2ccccc2)[nH]1.
What is the InChIKey of 2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine?
The InChIKey is BPZGZNLONLANFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3/c21-14-13-18-15-22-20(23-18)12-11-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,15,19H,11-14,21H2,(H,22,23).
What are the key properties of 2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine?
2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine has a molecular weight of 305.43 g/mol, XLogP of 3.68, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethanamine is sourced from PubChem (CID 10447834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).