N-benzhydryl-1-(furan-2-yl)methanimine

C18H15NO — CID 10730134

IUPACN-benzhydryl-1-(furan-2-yl)methanimine
SMILESC(=N/C(c1ccccc1)c1ccccc1)\c1ccco1
InChIInChI=1S/C18H15NO/c1-3-8-15(9-4-1)18(16-10-5-2-6-11-16)19-14-17-12-7-13-20-17/h1-14,18H/b19-14+
InChIKeyNUDJAGRGKRKASN-XMHGGMMESA-N
MW261.32 g/mol
LogP4.49
Rot. Bonds4

About N-benzhydryl-1-(furan-2-yl)methanimine

N-benzhydryl-1-(furan-2-yl)methanimine (PubChem CID 10730134) has the molecular formula C18H15NO and a molecular weight of 261.32 g/mol. Its IUPAC name is N-benzhydryl-1-(furan-2-yl)methanimine.

Molecular Properties

Compound NameN-benzhydryl-1-(furan-2-yl)methanimine
PubChem CID10730134
Molecular FormulaC18H15NO
Molecular Weight261.32 g/mol
Exact Mass261.12
IUPAC NameN-benzhydryl-1-(furan-2-yl)methanimine
SMILESC(=N/C(c1ccccc1)c1ccccc1)\c1ccco1
InChIInChI=1S/C18H15NO/c1-3-8-15(9-4-1)18(16-10-5-2-6-11-16)19-14-17-12-7-13-20-17/h1-14,18H/b19-14+
InChIKeyNUDJAGRGKRKASN-XMHGGMMESA-N
XLogP4.49
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-1-(furan-2-yl)methanimine?
The IUPAC name of N-benzhydryl-1-(furan-2-yl)methanimine (CID 10730134) is N-benzhydryl-1-(furan-2-yl)methanimine.
What is the SMILES notation for N-benzhydryl-1-(furan-2-yl)methanimine?
The canonical SMILES for N-benzhydryl-1-(furan-2-yl)methanimine is C(=N/C(c1ccccc1)c1ccccc1)\c1ccco1.
What is the InChIKey of N-benzhydryl-1-(furan-2-yl)methanimine?
The InChIKey is NUDJAGRGKRKASN-XMHGGMMESA-N. The full InChI is InChI=1S/C18H15NO/c1-3-8-15(9-4-1)18(16-10-5-2-6-11-16)19-14-17-12-7-13-20-17/h1-14,18H/b19-14+.
What are the key properties of N-benzhydryl-1-(furan-2-yl)methanimine?
N-benzhydryl-1-(furan-2-yl)methanimine has a molecular weight of 261.32 g/mol, XLogP of 4.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-1-(furan-2-yl)methanimine is sourced from PubChem (CID 10730134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).