N-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide

C17H19FN2O2 — CID 167842246

IUPACN-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide
SMILESCOCC1(C(=O)Nc2cnc3c(F)cccc3c2)CCCC1
InChIInChI=1S/C17H19FN2O2/c1-22-11-17(7-2-3-8-17)16(21)20-13-9-12-5-4-6-14(18)15(12)19-10-13/h4-6,9-10H,2-3,7-8,11H2,1H3,(H,20,21)
InChIKeyZPKQKUCICVVPCV-UHFFFAOYSA-N
MW302.35 g/mol
LogP3.52
Rot. Bonds4

About N-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide

N-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide (PubChem CID 167842246) has the molecular formula C17H19FN2O2 and a molecular weight of 302.35 g/mol. Its IUPAC name is N-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide
PubChem CID167842246
Molecular FormulaC17H19FN2O2
Molecular Weight302.35 g/mol
Exact Mass302.14
IUPAC NameN-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide
SMILESCOCC1(C(=O)Nc2cnc3c(F)cccc3c2)CCCC1
InChIInChI=1S/C17H19FN2O2/c1-22-11-17(7-2-3-8-17)16(21)20-13-9-12-5-4-6-14(18)15(12)19-10-13/h4-6,9-10H,2-3,7-8,11H2,1H3,(H,20,21)
InChIKeyZPKQKUCICVVPCV-UHFFFAOYSA-N
XLogP3.52
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.35
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide?
The IUPAC name of N-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide (CID 167842246) is N-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for N-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide?
The canonical SMILES for N-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide is COCC1(C(=O)Nc2cnc3c(F)cccc3c2)CCCC1.
What is the InChIKey of N-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide?
The InChIKey is ZPKQKUCICVVPCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O2/c1-22-11-17(7-2-3-8-17)16(21)20-13-9-12-5-4-6-14(18)15(12)19-10-13/h4-6,9-10H,2-3,7-8,11H2,1H3,(H,20,21).
What are the key properties of N-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide?
N-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide has a molecular weight of 302.35 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-fluoroquinolin-3-yl)-1-(methoxymethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 167842246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).