N-(1-phenylethylideneamino)quinolin-2-amine

C17H15N3 — CID 618819

IUPACN-(1-phenylethylideneamino)quinolin-2-amine
SMILESCC(=NNc1ccc2ccccc2n1)c1ccccc1
InChIInChI=1S/C17H15N3/c1-13(14-7-3-2-4-8-14)19-20-17-12-11-15-9-5-6-10-16(15)18-17/h2-12H,1H3,(H,18,20)
InChIKeyDKQDGZRUPWVTAE-UHFFFAOYSA-N
MW261.33 g/mol
LogP4.07
Rot. Bonds3

About N-(1-phenylethylideneamino)quinolin-2-amine

N-(1-phenylethylideneamino)quinolin-2-amine (PubChem CID 618819) has the molecular formula C17H15N3 and a molecular weight of 261.33 g/mol. Its IUPAC name is N-(1-phenylethylideneamino)quinolin-2-amine.

Molecular Properties

Compound NameN-(1-phenylethylideneamino)quinolin-2-amine
PubChem CID618819
Molecular FormulaC17H15N3
Molecular Weight261.33 g/mol
Exact Mass261.13
IUPAC NameN-(1-phenylethylideneamino)quinolin-2-amine
SMILESCC(=NNc1ccc2ccccc2n1)c1ccccc1
InChIInChI=1S/C17H15N3/c1-13(14-7-3-2-4-8-14)19-20-17-12-11-15-9-5-6-10-16(15)18-17/h2-12H,1H3,(H,18,20)
InChIKeyDKQDGZRUPWVTAE-UHFFFAOYSA-N
XLogP4.07
TPSA37.28 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 54.07
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

(2E)-2-(quinolin-2-ylhydrazinylidene)propanoic acid
CID 10059695
4-methyl-N-[(E)-1-phenylethylideneamino]quinolin-2-amine
CID 15352710
sodium N-quinolin-2-ylnitrous amide
CID 54608705
N-[4-(furan-2-yl)but-3-en-2-ylideneamino]quinolin-2-amine
CID 3319597
ethane;N-[(Z)-1-phenylethylideneamino]aniline
CID 91599108
3-hydroxy-2-[2-(1-phenylethylidene)hydrazinyl]quinazolin-4-one
CID 4888440
N-[1-(4-phenylphenyl)ethylideneamino]pyridin-2-amine
CID 3582287
4-[(E)-N-[(6-chloro-4-methylquinolin-2-yl)amino]-C-methylcarbonimidoyl]phenol
CID 135758857
4-[(quinolin-2-ylhydrazinylidene)methyl]benzene-1,2,3-triol
CID 3407357
3-[(quinolin-2-ylhydrazinylidene)methyl]benzene-1,2-diol
CID 4840474
4-tert-butyl-2,6-bis[(E)-(quinolin-2-ylhydrazinylidene)methyl]phenol
CID 135590058
N-[(E)-1-(4-aminophenyl)ethylideneamino]quinoline-2-carboxamide
CID 97186271

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylethylideneamino)quinolin-2-amine?
The IUPAC name of N-(1-phenylethylideneamino)quinolin-2-amine (CID 618819) is N-(1-phenylethylideneamino)quinolin-2-amine.
What is the SMILES notation for N-(1-phenylethylideneamino)quinolin-2-amine?
The canonical SMILES for N-(1-phenylethylideneamino)quinolin-2-amine is CC(=NNc1ccc2ccccc2n1)c1ccccc1.
What is the InChIKey of N-(1-phenylethylideneamino)quinolin-2-amine?
The InChIKey is DKQDGZRUPWVTAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3/c1-13(14-7-3-2-4-8-14)19-20-17-12-11-15-9-5-6-10-16(15)18-17/h2-12H,1H3,(H,18,20).
What are the key properties of N-(1-phenylethylideneamino)quinolin-2-amine?
N-(1-phenylethylideneamino)quinolin-2-amine has a molecular weight of 261.33 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylethylideneamino)quinolin-2-amine is sourced from PubChem (CID 618819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).