(2-methoxyindolizin-3-yl)-phenylmethanone

C16H13NO2 — CID 156847197

IUPAC(2-methoxyindolizin-3-yl)-phenylmethanone
SMILESCOc1cc2ccccn2c1C(=O)c1ccccc1
InChIInChI=1S/C16H13NO2/c1-19-14-11-13-9-5-6-10-17(13)15(14)16(18)12-7-3-2-4-8-12/h2-11H,1H3
InChIKeyMEQOTAYZGQUZPA-UHFFFAOYSA-N
MW251.29 g/mol
LogP3.18
Rot. Bonds3

About (2-methoxyindolizin-3-yl)-phenylmethanone

(2-methoxyindolizin-3-yl)-phenylmethanone (PubChem CID 156847197) has the molecular formula C16H13NO2 and a molecular weight of 251.29 g/mol. Its IUPAC name is (2-methoxyindolizin-3-yl)-phenylmethanone.

Molecular Properties

Compound Name(2-methoxyindolizin-3-yl)-phenylmethanone
PubChem CID156847197
Molecular FormulaC16H13NO2
Molecular Weight251.29 g/mol
Exact Mass251.09
IUPAC Name(2-methoxyindolizin-3-yl)-phenylmethanone
SMILESCOc1cc2ccccn2c1C(=O)c1ccccc1
InChIInChI=1S/C16H13NO2/c1-19-14-11-13-9-5-6-10-17(13)15(14)16(18)12-7-3-2-4-8-12/h2-11H,1H3
InChIKeyMEQOTAYZGQUZPA-UHFFFAOYSA-N
XLogP3.18
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2-phenylindolizin-3-yl)-(3,4,5-trimethoxyphenyl)methanone
CID 2359773
(2-methylindolizin-3-yl)-(4-phenoxyphenyl)methanone
CID 2326958
2-methoxy-3-methylindolizine
CID 12694398
2-tert-butyl-2-[3-(4-methoxybenzoyl)indolizin-2-yl]-4,4-dimethyl-3-oxopentanoic acid
CID 66993154
[2-(4-chlorophenyl)indolizin-3-yl]-(3-methoxyphenyl)methanone
CID 4067347
3-[2-(2,4-dimethoxyphenyl)indolizine-3-carbonyl]-N,N-diethylbenzenesulfonamide
CID 2327212
5-benzoylindolizine-7-carboxylic acid
CID 171758340
(3-methoxynaphthalen-2-yl)-phenylmethanone
CID 15855764
sodium 3-benzoyl-2-(4-methoxyphenyl)indolizine-7-carboxylate
CID 23670330
ethyl 2-acetylindolizine-3-carboxylate
CID 91665485
(2-amino-3-methoxyphenyl)-phenylmethanone
CID 18185399
[4-[3-(dibutylamino)propoxy]phenyl]-(2-phenylindolizin-3-yl)methanone
CID 12844816

Frequently Asked Questions

What is the IUPAC name of (2-methoxyindolizin-3-yl)-phenylmethanone?
The IUPAC name of (2-methoxyindolizin-3-yl)-phenylmethanone (CID 156847197) is (2-methoxyindolizin-3-yl)-phenylmethanone.
What is the SMILES notation for (2-methoxyindolizin-3-yl)-phenylmethanone?
The canonical SMILES for (2-methoxyindolizin-3-yl)-phenylmethanone is COc1cc2ccccn2c1C(=O)c1ccccc1.
What is the InChIKey of (2-methoxyindolizin-3-yl)-phenylmethanone?
The InChIKey is MEQOTAYZGQUZPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO2/c1-19-14-11-13-9-5-6-10-17(13)15(14)16(18)12-7-3-2-4-8-12/h2-11H,1H3.
What are the key properties of (2-methoxyindolizin-3-yl)-phenylmethanone?
(2-methoxyindolizin-3-yl)-phenylmethanone has a molecular weight of 251.29 g/mol, XLogP of 3.18, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxyindolizin-3-yl)-phenylmethanone is sourced from PubChem (CID 156847197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).