N-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine

C23H21N3 — CID 2319936

IUPACN-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine
SMILESCN(C)N=Cc1c(-c2ccccc2)n(-c2ccccc2)c2ccccc12
InChIInChI=1S/C23H21N3/c1-25(2)24-17-21-20-15-9-10-16-22(20)26(19-13-7-4-8-14-19)23(21)18-11-5-3-6-12-18/h3-17H,1-2H3
InChIKeyRXXHJCCQGJMEQZ-UHFFFAOYSA-N
MW339.44 g/mol
LogP5.19
Rot. Bonds4

About N-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine

N-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine (PubChem CID 2319936) has the molecular formula C23H21N3 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine.

Molecular Properties

Compound NameN-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine
PubChem CID2319936
Molecular FormulaC23H21N3
Molecular Weight339.44 g/mol
Exact Mass339.17
IUPAC NameN-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine
SMILESCN(C)N=Cc1c(-c2ccccc2)n(-c2ccccc2)c2ccccc12
InChIInChI=1S/C23H21N3/c1-25(2)24-17-21-20-15-9-10-16-22(20)26(19-13-7-4-8-14-19)23(21)18-11-5-3-6-12-18/h3-17H,1-2H3
InChIKeyRXXHJCCQGJMEQZ-UHFFFAOYSA-N
XLogP5.19
TPSA20.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.44
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

(Z)-1-(1,2-diphenylindol-3-yl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine
CID 7025608
4-[3-[(E)-hydroxyiminomethyl]-2-phenylindol-1-yl]phenol
CID 87343577
N-[(1,2-diphenylindol-3-yl)methylideneamino]benzenesulfonamide
CID 3485439
N-(2,4-dimethylphenyl)-1-(1,2-diphenylindol-3-yl)methanimine
CID 2307285
3-chloro-N-[(1,2-diphenylindol-3-yl)methylideneamino]aniline
CID 4190945
N-[(1,2-diphenylindol-3-yl)methylideneamino]-2,5-dimethylfuran-3-carboxamide
CID 2308479
methyl 3-(1,2-diphenylindol-3-yl)prop-2-enoate
CID 169479953
(E)-2-cyano-3-(1,2-diphenylindol-3-yl)prop-2-enamide
CID 2361503
3-[1,2-bis[4-(4-phenylphenyl)phenyl]indol-3-yl]-1,2-diphenylindole
CID 129085579
N-[(E)-(1,2-diphenylindol-3-yl)methylideneamino]-2-pyridin-1-ium-1-ylacetamide
CID 146021708
N-[(E)-(1,2-diphenylindol-3-yl)methylideneamino]-1H-indole-3-carboxamide
CID 6902143
2-(4-tert-butylphenoxy)-N-[(E)-(1,2-diphenylindol-3-yl)methylideneamino]acetamide
CID 6901775

Frequently Asked Questions

What is the IUPAC name of N-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine?
The IUPAC name of N-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine (CID 2319936) is N-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine.
What is the SMILES notation for N-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine?
The canonical SMILES for N-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine is CN(C)N=Cc1c(-c2ccccc2)n(-c2ccccc2)c2ccccc12.
What is the InChIKey of N-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine?
The InChIKey is RXXHJCCQGJMEQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3/c1-25(2)24-17-21-20-15-9-10-16-22(20)26(19-13-7-4-8-14-19)23(21)18-11-5-3-6-12-18/h3-17H,1-2H3.
What are the key properties of N-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine?
N-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine has a molecular weight of 339.44 g/mol, XLogP of 5.19, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,2-diphenylindol-3-yl)methylideneamino]-N-methylmethanamine is sourced from PubChem (CID 2319936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).