1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline

C15H14N2O — CID 170911357

IUPAC1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline
SMILESO=NN1CCCc2ccc(-c3ccccc3)cc21
InChIInChI=1S/C15H14N2O/c18-16-17-10-4-7-13-8-9-14(11-15(13)17)12-5-2-1-3-6-12/h1-3,5-6,8-9,11H,4,7,10H2
InChIKeyGCXALHGZFPQERK-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.79
Rot. Bonds2

About 1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline

1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline (PubChem CID 170911357) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline.

Molecular Properties

Compound Name1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline
PubChem CID170911357
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline
SMILESO=NN1CCCc2ccc(-c3ccccc3)cc21
InChIInChI=1S/C15H14N2O/c18-16-17-10-4-7-13-8-9-14(11-15(13)17)12-5-2-1-3-6-12/h1-3,5-6,8-9,11H,4,7,10H2
InChIKeyGCXALHGZFPQERK-UHFFFAOYSA-N
XLogP3.79
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5,13-diphenyltricyclo[9.4.0.02,7]pentadeca-1(11),2(7),3,5,12,14-hexaene
CID 163494691
2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone
CID 82051050
(E)-N-(3,4-dihydro-2H-quinolin-1-yl)-1-phenylmethanimine
CID 12914611
N-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine
CID 58794270
(6-phenyl-2,3-dihydroindol-1-yl)-pyrrolidin-3-ylmethanone
CID 175322800
(4-phenylphenyl)-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone
CID 67839485
1-(2-morpholin-4-ylethyl)-7-(3-phenylphenyl)-3,4-dihydroquinolin-2-one
CID 175346344
(E)-N-(3,4-dihydro-2H-quinolin-1-yl)ethanimine
CID 12023374
5-phenyl-2,3-dihydro-1H-isoindole
CID 19691969
1-(3,4-dihydro-2H-quinolin-1-yl)-2-(4-phenylphenoxy)ethanone
CID 2788983
1-methyl-4-[7-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]piperazine
CID 11660943
1,4-diphenylbenzene;1-methylpiperidine
CID 175507613

Frequently Asked Questions

What is the IUPAC name of 1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline?
The IUPAC name of 1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline (CID 170911357) is 1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline.
What is the SMILES notation for 1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline?
The canonical SMILES for 1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline is O=NN1CCCc2ccc(-c3ccccc3)cc21.
What is the InChIKey of 1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline?
The InChIKey is GCXALHGZFPQERK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c18-16-17-10-4-7-13-8-9-14(11-15(13)17)12-5-2-1-3-6-12/h1-3,5-6,8-9,11H,4,7,10H2.
What are the key properties of 1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline?
1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline has a molecular weight of 238.29 g/mol, XLogP of 3.79, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-nitroso-7-phenyl-3,4-dihydro-2H-quinoline is sourced from PubChem (CID 170911357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).