5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline

C18H17NO — CID 91077288

IUPAC5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline
SMILESC1=CC2N=C(c3ccccc3)C3CC=COC3C2C=C1
InChIInChI=1S/C18H17NO/c1-2-7-13(8-3-1)17-15-10-6-12-20-18(15)14-9-4-5-11-16(14)19-17/h1-9,11-12,14-16,18H,10H2
InChIKeyLPWNINAYRGFFHI-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.52
Rot. Bonds1

About 5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline

5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline (PubChem CID 91077288) has the molecular formula C18H17NO and a molecular weight of 263.34 g/mol. Its IUPAC name is 5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline.

Molecular Properties

Compound Name5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline
PubChem CID91077288
Molecular FormulaC18H17NO
Molecular Weight263.34 g/mol
Exact Mass263.13
IUPAC Name5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline
SMILESC1=CC2N=C(c3ccccc3)C3CC=COC3C2C=C1
InChIInChI=1S/C18H17NO/c1-2-7-13(8-3-1)17-15-10-6-12-20-18(15)14-9-4-5-11-16(14)19-17/h1-9,11-12,14-16,18H,10H2
InChIKeyLPWNINAYRGFFHI-UHFFFAOYSA-N
XLogP3.52
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline with MolForge

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Related Compounds

N-butyl-2-cyclohexa-1,3-dien-1-yl-6-(3-fluorophenyl)-8-methoxy-6,7,8,8a-tetrahydro-3H-quinolin-4-imine
CID 123927495
(4aS,10bS)-5-phenyl-3,4,4a,5,10a,10b-hexahydro-2H-pyrano[3,2-c]quinoline
CID 134863942
(1S,2R)-2-(benzhydrylideneamino)-1-cyclohexylbut-3-en-1-ol
CID 11056714
(1R,2S)-2-(benzhydrylideneamino)-1-cyclohexylbut-3-en-1-ol
CID 11121169
6-Methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine
CID 66680154
N-[4-(5-ethyl-3-methylcyclohexa-1,3-dien-1-yl)-6-pentoxy-2-propan-2-ylidenecyclohex-3-en-1-yl]-1-phenylethanimine
CID 123439532
N-[1-(2,6-dimethyloxan-4-yl)ethyl]-1,1-diphenylmethanimine
CID 126599319
2-benzyl-2H-3,1-benzoxazine
CID 151759656
1-Ethenyl-4-(2-methoxyethyl)-3-(2-methoxyprop-2-enyl)-3,4-dihydroisoquinoline
CID 155097253
2,4-diethyl-8-methoxy-2-methyl-N-(1-phenylethyl)quinolin-6-imine
CID 171819501
9-Benzyl-3,4a-dihydrofuro[3,4-b]quinoline
CID 173200392

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline?
The IUPAC name of 5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline (CID 91077288) is 5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline.
What is the SMILES notation for 5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline?
The canonical SMILES for 5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline is C1=CC2N=C(c3ccccc3)C3CC=COC3C2C=C1.
What is the InChIKey of 5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline?
The InChIKey is LPWNINAYRGFFHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO/c1-2-7-13(8-3-1)17-15-10-6-12-20-18(15)14-9-4-5-11-16(14)19-17/h1-9,11-12,14-16,18H,10H2.
What are the key properties of 5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline?
5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline has a molecular weight of 263.34 g/mol, XLogP of 3.52, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-4a,6a,10a,10b-tetrahydro-4H-pyrano[3,2-c]quinoline is sourced from PubChem (CID 91077288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).