(8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone

C15H16N2O2 — CID 110489868

IUPAC(8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone
SMILESCOc1cccc2cc(C(=O)N3CCCC3)cnc12
InChIInChI=1S/C15H16N2O2/c1-19-13-6-4-5-11-9-12(10-16-14(11)13)15(18)17-7-2-3-8-17/h4-6,9-10H,2-3,7-8H2,1H3
InChIKeyQHPKBZNZRMXTOL-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.48
Rot. Bonds2

About (8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone

(8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone (PubChem CID 110489868) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is (8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name(8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone
PubChem CID110489868
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name(8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone
SMILESCOc1cccc2cc(C(=O)N3CCCC3)cnc12
InChIInChI=1S/C15H16N2O2/c1-19-13-6-4-5-11-9-12(10-16-14(11)13)15(18)17-7-2-3-8-17/h4-6,9-10H,2-3,7-8H2,1H3
InChIKeyQHPKBZNZRMXTOL-UHFFFAOYSA-N
XLogP2.48
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[4-(2-methoxyphenyl)piperazin-1-yl]pyrimidin-5-yl]-pyrrolidin-1-ylmethanone
CID 109249260
(4-hydroxy-3,5-dimethoxyphenyl)-pyrrolidin-1-ylmethanone
CID 13410310
[5-chloro-6-(5-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridinyl]-piperidin-1-ylmethanone
CID 133450569
[2-(2-fluoro-6-methoxyphenyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone
CID 56701220
(2-fluoro-3-methoxyphenyl)-[4-(5-fluoropyridine-3-carbonyl)-1,4-diazepan-1-yl]methanone
CID 137334700
8-methoxy-N-(4-methylcyclohexyl)quinoline-3-carboxamide
CID 22136433
(4-iodo-3-methoxyphenyl)-pyrrolidin-1-ylmethanone
CID 155908718
[3-[(3aR,6aS)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]quinolin-8-yl]boronic acid
CID 174108509
[2-(3,4-dimethoxyanilino)pyrimidin-5-yl]-piperidin-1-ylmethanone
CID 109250030
(8-bromoquinolin-3-yl)-(4,4-difluoropiperidin-1-yl)methanone
CID 154667126
(3,4-dichlorophenyl)-[4-(2,6-dimethoxybenzoyl)-1,4-diazepan-1-yl]methanone
CID 108543906
azepan-1-yl-(3-methoxyphenyl)methanone
CID 669437

Frequently Asked Questions

What is the IUPAC name of (8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone?
The IUPAC name of (8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone (CID 110489868) is (8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone.
What is the SMILES notation for (8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone?
The canonical SMILES for (8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone is COc1cccc2cc(C(=O)N3CCCC3)cnc12.
What is the InChIKey of (8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone?
The InChIKey is QHPKBZNZRMXTOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-19-13-6-4-5-11-9-12(10-16-14(11)13)15(18)17-7-2-3-8-17/h4-6,9-10H,2-3,7-8H2,1H3.
What are the key properties of (8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone?
(8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone has a molecular weight of 256.31 g/mol, XLogP of 2.48, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8-methoxyquinolin-3-yl)-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 110489868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).