(2-phenylcyclopropyl)-quinolin-8-ylmethanone

C19H15NO — CID 115790655

IUPAC(2-phenylcyclopropyl)-quinolin-8-ylmethanone
SMILESO=C(c1cccc2cccnc12)C1CC1c1ccccc1
InChIInChI=1S/C19H15NO/c21-19(17-12-16(17)13-6-2-1-3-7-13)15-10-4-8-14-9-5-11-20-18(14)15/h1-11,16-17H,12H2
InChIKeyOFTZFNWSYSQJFP-UHFFFAOYSA-N
MW273.34 g/mol
LogP4.22
Rot. Bonds3

About (2-phenylcyclopropyl)-quinolin-8-ylmethanone

(2-phenylcyclopropyl)-quinolin-8-ylmethanone (PubChem CID 115790655) has the molecular formula C19H15NO and a molecular weight of 273.34 g/mol. Its IUPAC name is (2-phenylcyclopropyl)-quinolin-8-ylmethanone.

Molecular Properties

Compound Name(2-phenylcyclopropyl)-quinolin-8-ylmethanone
PubChem CID115790655
Molecular FormulaC19H15NO
Molecular Weight273.34 g/mol
Exact Mass273.12
IUPAC Name(2-phenylcyclopropyl)-quinolin-8-ylmethanone
SMILESO=C(c1cccc2cccnc12)C1CC1c1ccccc1
InChIInChI=1S/C19H15NO/c21-19(17-12-16(17)13-6-2-1-3-7-13)15-10-4-8-14-9-5-11-20-18(14)15/h1-11,16-17H,12H2
InChIKeyOFTZFNWSYSQJFP-UHFFFAOYSA-N
XLogP4.22
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[(1S,2R,4S)-2-bicyclo[2.2.1]hept-5-enyl]-quinolin-8-ylmethanone
CID 132534099
[(1R,2S)-2-phenylcyclopropyl]-pyridin-2-ylmethanone
CID 1471621
1-benzothiophen-7-yl-(2-phenylcyclopropyl)methanone
CID 115791036
2-phenyl-N-(quinolin-8-ylmethylideneamino)cyclopropane-1-carboxamide
CID 3594985
cyclopentyl(quinolin-8-yl)methanone
CID 81220027
palladium;quinoline-8-carboxylic acid
CID 174945118
[(4S,4aR,8aR)-4-phenyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-quinolin-8-ylmethanone
CID 71085948
(2,6-dimethyl-3-pyridinyl)-(2-phenylcyclopropyl)methanone
CID 105134802
(4-ethylcyclohexyl)-quinolin-8-ylmethanone
CID 81221024
8-hydroxy-N-(2-phenylcyclopropyl)quinoline-7-carboxamide
CID 20816868
N-(2-aminocyclopropyl)quinoline-8-carboxamide
CID 62875389
cis-(2S,6R)-2,6-diphenyl-N-quinolin-8-ylcyclohexane-1-carboxamide
CID 177490344

Frequently Asked Questions

What is the IUPAC name of (2-phenylcyclopropyl)-quinolin-8-ylmethanone?
The IUPAC name of (2-phenylcyclopropyl)-quinolin-8-ylmethanone (CID 115790655) is (2-phenylcyclopropyl)-quinolin-8-ylmethanone.
What is the SMILES notation for (2-phenylcyclopropyl)-quinolin-8-ylmethanone?
The canonical SMILES for (2-phenylcyclopropyl)-quinolin-8-ylmethanone is O=C(c1cccc2cccnc12)C1CC1c1ccccc1.
What is the InChIKey of (2-phenylcyclopropyl)-quinolin-8-ylmethanone?
The InChIKey is OFTZFNWSYSQJFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO/c21-19(17-12-16(17)13-6-2-1-3-7-13)15-10-4-8-14-9-5-11-20-18(14)15/h1-11,16-17H,12H2.
What are the key properties of (2-phenylcyclopropyl)-quinolin-8-ylmethanone?
(2-phenylcyclopropyl)-quinolin-8-ylmethanone has a molecular weight of 273.34 g/mol, XLogP of 4.22, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenylcyclopropyl)-quinolin-8-ylmethanone is sourced from PubChem (CID 115790655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).