(1-benzylpiperidin-4-yl)-diphenylmethanamine

C25H28N2 — CID 154244173

IUPAC(1-benzylpiperidin-4-yl)-diphenylmethanamine
SMILESNC(c1ccccc1)(c1ccccc1)C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C25H28N2/c26-25(22-12-6-2-7-13-22,23-14-8-3-9-15-23)24-16-18-27(19-17-24)20-21-10-4-1-5-11-21/h1-15,24H,16-20,26H2
InChIKeyAEHAXGAARGAJQY-UHFFFAOYSA-N
MW356.51 g/mol
LogP4.80
Rot. Bonds5

About (1-benzylpiperidin-4-yl)-diphenylmethanamine

(1-benzylpiperidin-4-yl)-diphenylmethanamine (PubChem CID 154244173) has the molecular formula C25H28N2 and a molecular weight of 356.51 g/mol. Its IUPAC name is (1-benzylpiperidin-4-yl)-diphenylmethanamine.

Molecular Properties

Compound Name(1-benzylpiperidin-4-yl)-diphenylmethanamine
PubChem CID154244173
Molecular FormulaC25H28N2
Molecular Weight356.51 g/mol
Exact Mass356.23
IUPAC Name(1-benzylpiperidin-4-yl)-diphenylmethanamine
SMILESNC(c1ccccc1)(c1ccccc1)C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C25H28N2/c26-25(22-12-6-2-7-13-22,23-14-8-3-9-15-23)24-16-18-27(19-17-24)20-21-10-4-1-5-11-21/h1-15,24H,16-20,26H2
InChIKeyAEHAXGAARGAJQY-UHFFFAOYSA-N
XLogP4.80
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.51
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-benzylpiperidin-4-yl)-diphenylmethanamine?
The IUPAC name of (1-benzylpiperidin-4-yl)-diphenylmethanamine (CID 154244173) is (1-benzylpiperidin-4-yl)-diphenylmethanamine.
What is the SMILES notation for (1-benzylpiperidin-4-yl)-diphenylmethanamine?
The canonical SMILES for (1-benzylpiperidin-4-yl)-diphenylmethanamine is NC(c1ccccc1)(c1ccccc1)C1CCN(Cc2ccccc2)CC1.
What is the InChIKey of (1-benzylpiperidin-4-yl)-diphenylmethanamine?
The InChIKey is AEHAXGAARGAJQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2/c26-25(22-12-6-2-7-13-22,23-14-8-3-9-15-23)24-16-18-27(19-17-24)20-21-10-4-1-5-11-21/h1-15,24H,16-20,26H2.
What are the key properties of (1-benzylpiperidin-4-yl)-diphenylmethanamine?
(1-benzylpiperidin-4-yl)-diphenylmethanamine has a molecular weight of 356.51 g/mol, XLogP of 4.80, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzylpiperidin-4-yl)-diphenylmethanamine is sourced from PubChem (CID 154244173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).