(6-methoxyquinolin-3-yl)-phenylmethanone

C17H13NO2 — CID 102416724

IUPAC(6-methoxyquinolin-3-yl)-phenylmethanone
SMILESCOc1ccc2ncc(C(=O)c3ccccc3)cc2c1
InChIInChI=1S/C17H13NO2/c1-20-15-7-8-16-13(10-15)9-14(11-18-16)17(19)12-5-3-2-4-6-12/h2-11H,1H3
InChIKeyHWFVDHQZPRWFFO-UHFFFAOYSA-N
MW263.30 g/mol
LogP3.47
Rot. Bonds3

About (6-methoxyquinolin-3-yl)-phenylmethanone

(6-methoxyquinolin-3-yl)-phenylmethanone (PubChem CID 102416724) has the molecular formula C17H13NO2 and a molecular weight of 263.30 g/mol. Its IUPAC name is (6-methoxyquinolin-3-yl)-phenylmethanone.

Molecular Properties

Compound Name(6-methoxyquinolin-3-yl)-phenylmethanone
PubChem CID102416724
Molecular FormulaC17H13NO2
Molecular Weight263.30 g/mol
Exact Mass263.09
IUPAC Name(6-methoxyquinolin-3-yl)-phenylmethanone
SMILESCOc1ccc2ncc(C(=O)c3ccccc3)cc2c1
InChIInChI=1S/C17H13NO2/c1-20-15-7-8-16-13(10-15)9-14(11-18-16)17(19)12-5-3-2-4-6-12/h2-11H,1H3
InChIKeyHWFVDHQZPRWFFO-UHFFFAOYSA-N
XLogP3.47
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 3-(6-methoxyquinolin-3-yl)-3-oxopropanoate
CID 82665608
N-(2-hydroxyethyl)-6-methoxyquinoline-3-carboxamide
CID 110489941
(6-methoxyquinolin-3-yl)carbamic acid
CID 22326813
[4-[2,2-bis(4-methoxyphenyl)-1-phenylethenyl]phenyl]-phenylmethanone
CID 134955229
4-(6-methoxynaphthalene-2-carbonyl)benzoic acid
CID 70129561
[5-(4-methoxybenzoyl)-3-pyridinyl]-(4-methoxyphenyl)methanone
CID 102584961
6-methoxy-N-morpholin-4-ylquinoline-3-carboxamide
CID 25222844
(4-chloro-6-methoxyquinolin-3-yl)-(4-methoxyphenyl)methanone
CID 53491110
(2-hydroxy-4-methoxyphenyl)-phenylmethanone;(4-methoxyphenyl)-phenylmethanone
CID 159601745
sodium;(3-methoxyphenyl)-phenylmethanone;hydroxide
CID 18779399
1-(6-methoxynaphthalen-2-yl)-3-phenylpropane-1,3-dione
CID 102495157
2-benzoyl-N-(7-methoxyquinolin-3-yl)benzamide
CID 54773922

Frequently Asked Questions

What is the IUPAC name of (6-methoxyquinolin-3-yl)-phenylmethanone?
The IUPAC name of (6-methoxyquinolin-3-yl)-phenylmethanone (CID 102416724) is (6-methoxyquinolin-3-yl)-phenylmethanone.
What is the SMILES notation for (6-methoxyquinolin-3-yl)-phenylmethanone?
The canonical SMILES for (6-methoxyquinolin-3-yl)-phenylmethanone is COc1ccc2ncc(C(=O)c3ccccc3)cc2c1.
What is the InChIKey of (6-methoxyquinolin-3-yl)-phenylmethanone?
The InChIKey is HWFVDHQZPRWFFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NO2/c1-20-15-7-8-16-13(10-15)9-14(11-18-16)17(19)12-5-3-2-4-6-12/h2-11H,1H3.
What are the key properties of (6-methoxyquinolin-3-yl)-phenylmethanone?
(6-methoxyquinolin-3-yl)-phenylmethanone has a molecular weight of 263.30 g/mol, XLogP of 3.47, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxyquinolin-3-yl)-phenylmethanone is sourced from PubChem (CID 102416724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).