1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide

C17H21N3O2 — CID 168698156

IUPAC1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(c2c3c(nc4c2CCC4)CCCC3)C1
InChIInChI=1S/C17H21N3O2/c18-17(22)10-8-15(21)20(9-10)16-11-4-1-2-6-13(11)19-14-7-3-5-12(14)16/h10H,1-9H2,(H2,18,22)
InChIKeyOYZHHBJXCSZPGZ-UHFFFAOYSA-N
MW299.37 g/mol
LogP1.29
Rot. Bonds2

About 1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide

1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 168698156) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is 1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide
PubChem CID168698156
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC Name1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(c2c3c(nc4c2CCC4)CCCC3)C1
InChIInChI=1S/C17H21N3O2/c18-17(22)10-8-15(21)20(9-10)16-11-4-1-2-6-13(11)19-14-7-3-5-12(14)16/h10H,1-9H2,(H2,18,22)
InChIKeyOYZHHBJXCSZPGZ-UHFFFAOYSA-N
XLogP1.29
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide with MolForge

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Related Compounds

1-(2-amino-4,6-difluorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 168698300
5-oxo-1-[6-(trifluoromethyl)-2-pyridinyl]pyrrolidine-3-carboxamide
CID 168698366
1-(2-chloro-6-cyanophenyl)-5-oxopyrrolidine-3-carboxamide
CID 168697513
(3S)-1-[3-[(4R)-4-carbamoyl-2-oxopyrrolidin-1-yl]phenyl]-5-oxopyrrolidine-3-carboxamide
CID 94076238
1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide
CID 168698612
5-oxo-1-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-3-carboxamide
CID 168697848
4-(4-carbamoyl-2-oxopyrrolidin-1-yl)-3-methylbenzoic acid
CID 168696744
2-(4-carbamoyl-2-oxopyrrolidin-1-yl)-3-iodobenzoic acid
CID 168697535
1-(4-aminophenyl)-5-oxopyrrolidine-3-carboxamide
CID 168697847
1-(3-amino-5-bromopyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide
CID 168698071
1-(4-amino-6-methoxypyrimidin-2-yl)-5-oxopyrrolidine-3-carboxamide
CID 168696634
1-(2-bromo-4-chloro-6-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 168696945

Frequently Asked Questions

What is the IUPAC name of 1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide (CID 168698156) is 1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide is NC(=O)C1CC(=O)N(c2c3c(nc4c2CCC4)CCCC3)C1.
What is the InChIKey of 1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is OYZHHBJXCSZPGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2/c18-17(22)10-8-15(21)20(9-10)16-11-4-1-2-6-13(11)19-14-7-3-5-12(14)16/h10H,1-9H2,(H2,18,22).
What are the key properties of 1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide?
1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 299.37 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 168698156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).