7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline

C18H21FN2O — CID 22641395

IUPAC7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline
SMILESCc1cc(N2CCCC2)c2cc(F)c(OCC3CC3)cc2n1
InChIInChI=1S/C18H21FN2O/c1-12-8-17(21-6-2-3-7-21)14-9-15(19)18(10-16(14)20-12)22-11-13-4-5-13/h8-10,13H,2-7,11H2,1H3
InChIKeyXEMNDKKIGHIRCJ-UHFFFAOYSA-N
MW300.38 g/mol
LogP4.07
Rot. Bonds4

About 7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline

7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline (PubChem CID 22641395) has the molecular formula C18H21FN2O and a molecular weight of 300.38 g/mol. Its IUPAC name is 7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline.

Molecular Properties

Compound Name7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline
PubChem CID22641395
Molecular FormulaC18H21FN2O
Molecular Weight300.38 g/mol
Exact Mass300.16
IUPAC Name7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline
SMILESCc1cc(N2CCCC2)c2cc(F)c(OCC3CC3)cc2n1
InChIInChI=1S/C18H21FN2O/c1-12-8-17(21-6-2-3-7-21)14-9-15(19)18(10-16(14)20-12)22-11-13-4-5-13/h8-10,13H,2-7,11H2,1H3
InChIKeyXEMNDKKIGHIRCJ-UHFFFAOYSA-N
XLogP4.07
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline 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

6-fluoro-7-[(2-fluoro-3-pyridinyl)methoxy]-2-methyl-4-pyrrolidin-1-ylquinoline
CID 10108852
4-[(6-bromo-2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)oxymethyl]benzonitrile
CID 22641412
7-[(4-fluorophenoxy)methyl]-2-methyl-4-pyrrolidin-1-ylquinoline
CID 22054474
6-fluoro-2-methyl-4-[4-(2-pyrrolidin-1-ylethoxy)piperidin-1-yl]quinoline
CID 133368472
2-methyl-7-(2-methylpropoxy)-4-pyrrolidin-1-ylquinoline
CID 22641435
N-(2-methoxyethyl)-2-methyl-4-pyrrolidin-1-ylquinolin-7-amine
CID 23433978
7,8-difluoro-2-methyl-4-pyrrolidin-1-ylquinoline
CID 133499902
[1-[2-[2-(azetidin-1-yl)-1,3-thiazol-5-yl]-6-fluoro-7-methoxyquinolin-4-yl]pyrrolidin-3-yl]methanol
CID 177174075
[1-[2-[6-(azetidin-1-yl)-3-pyridinyl]-6-fluoro-7-methoxyquinolin-4-yl]pyrrolidin-3-yl]methanol
CID 177174104
(6-bromo-2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)methyl formate
CID 174433356
2-methyl-7-propan-2-yloxy-4-pyrrolidin-1-ylquinoline
CID 22641342
cyclobutanecarboxylic acid;2-methyl-4-pyrrolidin-1-ylquinoline
CID 158504598

Frequently Asked Questions

What is the IUPAC name of 7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline?
The IUPAC name of 7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline (CID 22641395) is 7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline.
What is the SMILES notation for 7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline?
The canonical SMILES for 7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline is Cc1cc(N2CCCC2)c2cc(F)c(OCC3CC3)cc2n1.
What is the InChIKey of 7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline?
The InChIKey is XEMNDKKIGHIRCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2O/c1-12-8-17(21-6-2-3-7-21)14-9-15(19)18(10-16(14)20-12)22-11-13-4-5-13/h8-10,13H,2-7,11H2,1H3.
What are the key properties of 7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline?
7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline has a molecular weight of 300.38 g/mol, XLogP of 4.07, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclopropylmethoxy)-6-fluoro-2-methyl-4-pyrrolidin-1-ylquinoline is sourced from PubChem (CID 22641395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).