N-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine

C22H20N2 — CID 12752584

IUPACN-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine
SMILESCCn1c2ccccc2c2cc(/N=C/c3cccc(C)c3)ccc21
InChIInChI=1S/C22H20N2/c1-3-24-21-10-5-4-9-19(21)20-14-18(11-12-22(20)24)23-15-17-8-6-7-16(2)13-17/h4-15H,3H2,1-2H3/b23-15+
InChIKeySYVFVBSFFFICFM-HZHRSRAPSA-N
MW312.42 g/mol
LogP5.87
Rot. Bonds3

About N-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine

N-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine (PubChem CID 12752584) has the molecular formula C22H20N2 and a molecular weight of 312.42 g/mol. Its IUPAC name is N-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine.

Molecular Properties

Compound NameN-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine
PubChem CID12752584
Molecular FormulaC22H20N2
Molecular Weight312.42 g/mol
Exact Mass312.16
IUPAC NameN-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine
SMILESCCn1c2ccccc2c2cc(/N=C/c3cccc(C)c3)ccc21
InChIInChI=1S/C22H20N2/c1-3-24-21-10-5-4-9-19(21)20-14-18(11-12-22(20)24)23-15-17-8-6-7-16(2)13-17/h4-15H,3H2,1-2H3/b23-15+
InChIKeySYVFVBSFFFICFM-HZHRSRAPSA-N
XLogP5.87
TPSA17.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.42
LogP ≤ 55.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(3,4-difluorophenyl)-N-(9-ethylcarbazol-3-yl)methanimine
CID 23989157
4-[(9-ethylcarbazol-3-yl)methylideneamino]-N,N-dimethylaniline
CID 12752582
N-(9-ethylcarbazol-3-yl)methanimine
CID 163885182
1-(9-ethylcarbazol-3-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)methanimine
CID 4570449
9-ethyl-2-methylcarbazole
CID 19788789
N-(3,4-dimethyl-1,2-oxazol-5-yl)-1-(9-ethylcarbazol-3-yl)methanimine
CID 78146609
1-(9-ethylcarbazol-3-yl)-N-(1,2,4-triazol-4-yl)methanimine
CID 781157
(Z)-1-(9-ethylcarbazol-3-yl)-N-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanimine
CID 172983137
N-[(E)-(9-ethyl-6-methylcarbazol-3-yl)methylideneamino]-N-phenylaniline
CID 20650346
N-[(9-ethylcarbazol-3-yl)methylideneamino]-N,4-dimethylbenzenesulfonamide
CID 23960642
N-(3-methoxyphenyl)-1-(3-methylphenyl)methanimine
CID 86728778
2,5-dichloro-3,6-bis[(9-ethylcarbazol-3-yl)imino]cyclohexane-1,4-dione
CID 56636429

Frequently Asked Questions

What is the IUPAC name of N-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine?
The IUPAC name of N-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine (CID 12752584) is N-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine.
What is the SMILES notation for N-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine?
The canonical SMILES for N-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine is CCn1c2ccccc2c2cc(/N=C/c3cccc(C)c3)ccc21.
What is the InChIKey of N-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine?
The InChIKey is SYVFVBSFFFICFM-HZHRSRAPSA-N. The full InChI is InChI=1S/C22H20N2/c1-3-24-21-10-5-4-9-19(21)20-14-18(11-12-22(20)24)23-15-17-8-6-7-16(2)13-17/h4-15H,3H2,1-2H3/b23-15+.
What are the key properties of N-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine?
N-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine has a molecular weight of 312.42 g/mol, XLogP of 5.87, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-ethylcarbazol-3-yl)-1-(3-methylphenyl)methanimine is sourced from PubChem (CID 12752584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).