N-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine

C14H22N4 — CID 122474996

IUPACN-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine
SMILESCC(C)N(/N=C/c1ccc(/C=N/N)cc1)C(C)C
InChIInChI=1S/C14H22N4/c1-11(2)18(12(3)4)17-10-14-7-5-13(6-8-14)9-16-15/h5-12H,15H2,1-4H3/b16-9+,17-10+
InChIKeyUBRQQLABHZHBJY-CZCYGEDCSA-N
MW246.36 g/mol
LogP2.43
Rot. Bonds5

About N-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine

N-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine (PubChem CID 122474996) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is N-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine
PubChem CID122474996
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC NameN-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine
SMILESCC(C)N(/N=C/c1ccc(/C=N/N)cc1)C(C)C
InChIInChI=1S/C14H22N4/c1-11(2)18(12(3)4)17-10-14-7-5-13(6-8-14)9-16-15/h5-12H,15H2,1-4H3/b16-9+,17-10+
InChIKeyUBRQQLABHZHBJY-CZCYGEDCSA-N
XLogP2.43
TPSA53.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine (CID 122474996) is N-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine is CC(C)N(/N=C/c1ccc(/C=N/N)cc1)C(C)C.
What is the InChIKey of N-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine?
The InChIKey is UBRQQLABHZHBJY-CZCYGEDCSA-N. The full InChI is InChI=1S/C14H22N4/c1-11(2)18(12(3)4)17-10-14-7-5-13(6-8-14)9-16-15/h5-12H,15H2,1-4H3/b16-9+,17-10+.
What are the key properties of N-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine?
N-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine has a molecular weight of 246.36 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-[4-[(E)-hydrazinylidenemethyl]phenyl]methylideneamino]-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 122474996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).