N-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine

C20H19NO — CID 10541454

IUPACN-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine
SMILESCCC(N=C(c1ccccc1)c1ccccc1)c1ccco1
InChIInChI=1S/C20H19NO/c1-2-18(19-14-9-15-22-19)21-20(16-10-5-3-6-11-16)17-12-7-4-8-13-17/h3-15,18H,2H2,1H3
InChIKeyZXVZTDKPNFIDHI-UHFFFAOYSA-N
MW289.38 g/mol
LogP5.27
Rot. Bonds5

About N-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine

N-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine (PubChem CID 10541454) has the molecular formula C20H19NO and a molecular weight of 289.38 g/mol. Its IUPAC name is N-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine.

Molecular Properties

Compound NameN-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine
PubChem CID10541454
Molecular FormulaC20H19NO
Molecular Weight289.38 g/mol
Exact Mass289.15
IUPAC NameN-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine
SMILESCCC(N=C(c1ccccc1)c1ccccc1)c1ccco1
InChIInChI=1S/C20H19NO/c1-2-18(19-14-9-15-22-19)21-20(16-10-5-3-6-11-16)17-12-7-4-8-13-17/h3-15,18H,2H2,1H3
InChIKeyZXVZTDKPNFIDHI-UHFFFAOYSA-N
XLogP5.27
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500289.38
LogP ≤ 55.27
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-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine?
The IUPAC name of N-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine (CID 10541454) is N-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine.
What is the SMILES notation for N-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine?
The canonical SMILES for N-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine is CCC(N=C(c1ccccc1)c1ccccc1)c1ccco1.
What is the InChIKey of N-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine?
The InChIKey is ZXVZTDKPNFIDHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO/c1-2-18(19-14-9-15-22-19)21-20(16-10-5-3-6-11-16)17-12-7-4-8-13-17/h3-15,18H,2H2,1H3.
What are the key properties of N-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine?
N-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine has a molecular weight of 289.38 g/mol, XLogP of 5.27, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)propyl]-1,1-diphenylmethanimine is sourced from PubChem (CID 10541454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).