N-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine

C23H24N4 — CID 91258409

IUPACN-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine
SMILESCC(=NN(C)N(C)N=C(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C23H24N4/c1-19(20-13-7-4-8-14-20)24-26(2)27(3)25-23(21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18H,1-3H3
InChIKeyXNOBXXVXYOQKNH-UHFFFAOYSA-N
MW356.47 g/mol
LogP4.64
Rot. Bonds6

About N-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine

N-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine (PubChem CID 91258409) has the molecular formula C23H24N4 and a molecular weight of 356.47 g/mol. Its IUPAC name is N-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine.

Molecular Properties

Compound NameN-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine
PubChem CID91258409
Molecular FormulaC23H24N4
Molecular Weight356.47 g/mol
Exact Mass356.20
IUPAC NameN-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine
SMILESCC(=NN(C)N(C)N=C(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C23H24N4/c1-19(20-13-7-4-8-14-20)24-26(2)27(3)25-23(21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18H,1-3H3
InChIKeyXNOBXXVXYOQKNH-UHFFFAOYSA-N
XLogP4.64
TPSA31.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopropyl-N-[(E)-1-phenylethylideneamino]cyclopropanamine
CID 177445849
2-chloro-N-(2-chloroethyl)-N-[(Z)-1-phenylethylideneamino]ethanamine
CID 6536929
N-[(3Z)-2-methylpenta-1,3-dien-3-yl]-1-phenylethanimine
CID 126661807
N-tert-butyl-1,1-diphenylmethan(15N)imine
CID 170780662
nickel(2+);bis(1-(1-phenylethylidenehydrazinylidene)-1-sulfidoethane)
CID 5245817
CID 127025281
CID 127025281
N-methyl-N-[1-(1-methylpyridin-1-ium-4-yl)ethylideneamino]aniline
CID 71404149
1-(benzhydrylideneamino)ethylidenechromium
CID 11463699
4-[(Z)-N-(dimethylamino)-C-methylcarbonimidoyl]-N,N-dimethylaniline
CID 172971736
N-(benzhydrylideneamino)-N-phenyl-4-[(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]aniline
CID 146386348
N-(benzhydrylideneamino)-4-(2-methylbut-3-en-2-yl)-N-phenylaniline
CID 155196477
(E)-N-[(E)-benzylideneamino]-1-phenylethanimine
CID 177482711

Frequently Asked Questions

What is the IUPAC name of N-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine?
The IUPAC name of N-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine (CID 91258409) is N-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine.
What is the SMILES notation for N-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine?
The canonical SMILES for N-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine is CC(=NN(C)N(C)N=C(c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of N-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine?
The InChIKey is XNOBXXVXYOQKNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4/c1-19(20-13-7-4-8-14-20)24-26(2)27(3)25-23(21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18H,1-3H3.
What are the key properties of N-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine?
N-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine has a molecular weight of 356.47 g/mol, XLogP of 4.64, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(benzhydrylideneamino)-methylamino]-N-(1-phenylethylideneamino)methanamine is sourced from PubChem (CID 91258409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).