[2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone

C17H17FN2O2 — CID 56701220

IUPAC[2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESCOc1cccc(F)c1-c1cc(C(=O)N2CCCC2)ccn1
InChIInChI=1S/C17H17FN2O2/c1-22-15-6-4-5-13(18)16(15)14-11-12(7-8-19-14)17(21)20-9-2-3-10-20/h4-8,11H,2-3,9-10H2,1H3
InChIKeyRWPMCTMNMGYHEG-UHFFFAOYSA-N
MW300.33 g/mol
LogP3.13
Rot. Bonds3

About [2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone

[2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone (PubChem CID 56701220) has the molecular formula C17H17FN2O2 and a molecular weight of 300.33 g/mol. Its IUPAC name is [2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone
PubChem CID56701220
Molecular FormulaC17H17FN2O2
Molecular Weight300.33 g/mol
Exact Mass300.13
IUPAC Name[2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESCOc1cccc(F)c1-c1cc(C(=O)N2CCCC2)ccn1
InChIInChI=1S/C17H17FN2O2/c1-22-15-6-4-5-13(18)16(15)14-11-12(7-8-19-14)17(21)20-9-2-3-10-20/h4-8,11H,2-3,9-10H2,1H3
InChIKeyRWPMCTMNMGYHEG-UHFFFAOYSA-N
XLogP3.13
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.33
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(2,6-dimethoxybenzoyl)-1,4-diazepan-1-yl]-(3-fluorophenyl)methanone
CID 108544554
azocan-1-yl-(3-fluoro-4-methoxyphenyl)methanone
CID 86906608
(8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone
CID 110489868
2-(2-fluoro-6-methoxyphenyl)pyridine
CID 66942163
(3-fluoro-4-methoxyphenyl)-[4-(pyridine-3-carbonyl)-1,4-diazepan-1-yl]methanone
CID 110808459
azepan-1-yl-(3-methoxyphenyl)methanone
CID 669437
[4-(2-chloro-6-fluorobenzoyl)-1,4-diazepan-1-yl]-(3,4,5-trimethoxyphenyl)methanone
CID 108544165
(4-iodo-3-methoxyphenyl)-pyrrolidin-1-ylmethanone
CID 155908718
(4-fluoro-3-methylphenyl)-[4-(2-methoxybenzoyl)-1,4-diazepan-1-yl]methanone
CID 110816500
[2-[3-(2-fluorophenoxy)azetidin-1-yl]-4-pyridinyl]-pyrrolidin-1-ylmethanone
CID 135117191
(3-bromophenyl)-[4-(2,6-dimethoxybenzoyl)-1,4-diazepan-1-yl]methanone
CID 108544504
(3-fluorophenyl)-[4-(4-methoxy-3-methylbenzoyl)piperazin-1-yl]methanone
CID 110802324

Frequently Asked Questions

What is the IUPAC name of [2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone (CID 56701220) is [2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone is COc1cccc(F)c1-c1cc(C(=O)N2CCCC2)ccn1.
What is the InChIKey of [2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone?
The InChIKey is RWPMCTMNMGYHEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O2/c1-22-15-6-4-5-13(18)16(15)14-11-12(7-8-19-14)17(21)20-9-2-3-10-20/h4-8,11H,2-3,9-10H2,1H3.
What are the key properties of [2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone?
[2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone has a molecular weight of 300.33 g/mol, XLogP of 3.13, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 56701220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).