(Z)-N-benzyl-4-benzyliminopent-2-en-2-amine

C19H22N2 — CID 102416179

IUPAC(Z)-N-benzyl-4-benzyliminopent-2-en-2-amine
SMILESC/C(=C/C(C)=N/Cc1ccccc1)NCc1ccccc1
InChIInChI=1S/C19H22N2/c1-16(20-14-18-9-5-3-6-10-18)13-17(2)21-15-19-11-7-4-8-12-19/h3-13,20H,14-15H2,1-2H3/b16-13-,21-17+
InChIKeyYVMSMMFQBRRGGJ-ZFBPBYTNSA-N
MW278.40 g/mol
LogP4.34
Rot. Bonds6

About (Z)-N-benzyl-4-benzyliminopent-2-en-2-amine

(Z)-N-benzyl-4-benzyliminopent-2-en-2-amine (PubChem CID 102416179) has the molecular formula C19H22N2 and a molecular weight of 278.40 g/mol. Its IUPAC name is (Z)-N-benzyl-4-benzyliminopent-2-en-2-amine.

Molecular Properties

Compound Name(Z)-N-benzyl-4-benzyliminopent-2-en-2-amine
PubChem CID102416179
Molecular FormulaC19H22N2
Molecular Weight278.40 g/mol
Exact Mass278.18
IUPAC Name(Z)-N-benzyl-4-benzyliminopent-2-en-2-amine
SMILESC/C(=C/C(C)=N/Cc1ccccc1)NCc1ccccc1
InChIInChI=1S/C19H22N2/c1-16(20-14-18-9-5-3-6-10-18)13-17(2)21-15-19-11-7-4-8-12-19/h3-13,20H,14-15H2,1-2H3/b16-13-,21-17+
InChIKeyYVMSMMFQBRRGGJ-ZFBPBYTNSA-N
XLogP4.34
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 54.34
H-Bond Donors ≤ 51
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 (Z)-N-benzyl-4-benzyliminopent-2-en-2-amine?
The IUPAC name of (Z)-N-benzyl-4-benzyliminopent-2-en-2-amine (CID 102416179) is (Z)-N-benzyl-4-benzyliminopent-2-en-2-amine.
What is the SMILES notation for (Z)-N-benzyl-4-benzyliminopent-2-en-2-amine?
The canonical SMILES for (Z)-N-benzyl-4-benzyliminopent-2-en-2-amine is C/C(=C/C(C)=N/Cc1ccccc1)NCc1ccccc1.
What is the InChIKey of (Z)-N-benzyl-4-benzyliminopent-2-en-2-amine?
The InChIKey is YVMSMMFQBRRGGJ-ZFBPBYTNSA-N. The full InChI is InChI=1S/C19H22N2/c1-16(20-14-18-9-5-3-6-10-18)13-17(2)21-15-19-11-7-4-8-12-19/h3-13,20H,14-15H2,1-2H3/b16-13-,21-17+.
What are the key properties of (Z)-N-benzyl-4-benzyliminopent-2-en-2-amine?
(Z)-N-benzyl-4-benzyliminopent-2-en-2-amine has a molecular weight of 278.40 g/mol, XLogP of 4.34, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-benzyl-4-benzyliminopent-2-en-2-amine is sourced from PubChem (CID 102416179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).