N-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine

C18H17N3 — CID 29250260

IUPACN-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine
SMILESCc1ccc(/C=N\Nc2ccc3ccccc3n2)c(C)c1
InChIInChI=1S/C18H17N3/c1-13-7-8-16(14(2)11-13)12-19-21-18-10-9-15-5-3-4-6-17(15)20-18/h3-12H,1-2H3,(H,20,21)/b19-12-
InChIKeyJEBOYDHIUAHHFL-UNOMPAQXSA-N
MW275.36 g/mol
LogP4.30
Rot. Bonds3

About N-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine

N-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine (PubChem CID 29250260) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is N-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine.

Molecular Properties

Compound NameN-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine
PubChem CID29250260
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC NameN-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine
SMILESCc1ccc(/C=N\Nc2ccc3ccccc3n2)c(C)c1
InChIInChI=1S/C18H17N3/c1-13-7-8-16(14(2)11-13)12-19-21-18-10-9-15-5-3-4-6-17(15)20-18/h3-12H,1-2H3,(H,20,21)/b19-12-
InChIKeyJEBOYDHIUAHHFL-UNOMPAQXSA-N
XLogP4.30
TPSA37.28 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 54.30
H-Bond Donors ≤ 51
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

4-tert-butyl-2,6-bis[(E)-(quinolin-2-ylhydrazinylidene)methyl]phenol
CID 135590058
4-[(quinolin-2-ylhydrazinylidene)methyl]benzene-1,2,3-triol
CID 3407357
3-[(quinolin-2-ylhydrazinylidene)methyl]benzene-1,2-diol
CID 4840474
N-[(Z)-(2,4-dimethylphenyl)methylideneamino]-1,3-benzothiazol-2-amine
CID 9017119
N-[(2,4-dimethylphenyl)methylideneamino]-5-(trifluoromethyl)pyridin-2-amine
CID 4854807
2,6-ditert-butyl-4-[(Z)-(quinolin-2-ylhydrazinylidene)methyl]phenol
CID 136690371
4-nitro-2-[(E)-(quinolin-2-ylhydrazinylidene)methyl]phenol
CID 135642191
4-[(quinolin-2-ylhydrazinylidene)methyl]benzonitrile
CID 3537773
N-[(Z)-(10-chloroanthracen-9-yl)methylideneamino]quinolin-2-amine
CID 6059144
2,6-dibromo-4-[(E)-(quinolin-2-ylhydrazinylidene)methyl]phenol;hydrochloride
CID 163327922
N-[(1,3-diphenylpyrazol-4-yl)methylideneamino]quinolin-2-amine
CID 5213107
5-(hydroxymethyl)-2-methyl-4-[(E)-(quinolin-2-ylhydrazinylidene)methyl]pyridin-3-ol
CID 135537580

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine?
The IUPAC name of N-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine (CID 29250260) is N-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine.
What is the SMILES notation for N-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine?
The canonical SMILES for N-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine is Cc1ccc(/C=N\Nc2ccc3ccccc3n2)c(C)c1.
What is the InChIKey of N-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine?
The InChIKey is JEBOYDHIUAHHFL-UNOMPAQXSA-N. The full InChI is InChI=1S/C18H17N3/c1-13-7-8-16(14(2)11-13)12-19-21-18-10-9-15-5-3-4-6-17(15)20-18/h3-12H,1-2H3,(H,20,21)/b19-12-.
What are the key properties of N-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine?
N-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine has a molecular weight of 275.36 g/mol, XLogP of 4.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2,4-dimethylphenyl)methylideneamino]quinolin-2-amine is sourced from PubChem (CID 29250260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).