8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide

C19H23N3O3 — CID 126816346

IUPAC8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide
SMILESCCNC(=O)c1ccc2cccnc2c1OCC(=O)NC1CCCC1
InChIInChI=1S/C19H23N3O3/c1-2-20-19(24)15-10-9-13-6-5-11-21-17(13)18(15)25-12-16(23)22-14-7-3-4-8-14/h5-6,9-11,14H,2-4,7-8,12H2,1H3,(H,20,24)(H,22,23)
InChIKeyIOAYSILERVTDQZ-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.42
Rot. Bonds6

About 8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide

8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide (PubChem CID 126816346) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide.

Molecular Properties

Compound Name8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide
PubChem CID126816346
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide
SMILESCCNC(=O)c1ccc2cccnc2c1OCC(=O)NC1CCCC1
InChIInChI=1S/C19H23N3O3/c1-2-20-19(24)15-10-9-13-6-5-11-21-17(13)18(15)25-12-16(23)22-14-7-3-4-8-14/h5-6,9-11,14H,2-4,7-8,12H2,1H3,(H,20,24)(H,22,23)
InChIKeyIOAYSILERVTDQZ-UHFFFAOYSA-N
XLogP2.42
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide?
The IUPAC name of 8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide (CID 126816346) is 8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide.
What is the SMILES notation for 8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide?
The canonical SMILES for 8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide is CCNC(=O)c1ccc2cccnc2c1OCC(=O)NC1CCCC1.
What is the InChIKey of 8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide?
The InChIKey is IOAYSILERVTDQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-2-20-19(24)15-10-9-13-6-5-11-21-17(13)18(15)25-12-16(23)22-14-7-3-4-8-14/h5-6,9-11,14H,2-4,7-8,12H2,1H3,(H,20,24)(H,22,23).
What are the key properties of 8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide?
8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 2.42, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-(cyclopentylamino)-2-oxoethoxy]-N-ethylquinoline-7-carboxamide is sourced from PubChem (CID 126816346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).