2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide

C18H19N3O2 — CID 109131957

IUPAC2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide
SMILESO=C(Nc1cccc2cccnc12)C1CC1C(=O)N1CCCC1
InChIInChI=1S/C18H19N3O2/c22-17(13-11-14(13)18(23)21-9-1-2-10-21)20-15-7-3-5-12-6-4-8-19-16(12)15/h3-8,13-14H,1-2,9-11H2,(H,20,22)
InChIKeyAHFIDLWOMXPTCR-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.43
Rot. Bonds3

About 2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide

2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide (PubChem CID 109131957) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is 2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide
PubChem CID109131957
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC Name2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide
SMILESO=C(Nc1cccc2cccnc12)C1CC1C(=O)N1CCCC1
InChIInChI=1S/C18H19N3O2/c22-17(13-11-14(13)18(23)21-9-1-2-10-21)20-15-7-3-5-12-6-4-8-19-16(12)15/h3-8,13-14H,1-2,9-11H2,(H,20,22)
InChIKeyAHFIDLWOMXPTCR-UHFFFAOYSA-N
XLogP2.43
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-phenyl-1-N-quinolin-8-ylcyclopropane-1,2-dicarboxamide
CID 109140873
1-(cyclobutanecarbonyl)-N-quinolin-8-ylpiperidine-4-carboxamide
CID 113008383
1-N-(2,6-difluorophenyl)-2-N-quinolin-8-ylcyclopropane-1,2-dicarboxamide
CID 109144099
1-N-(2,6-dimethylphenyl)-2-N-quinolin-8-ylcyclopropane-1,2-dicarboxamide
CID 109141882
1-N-quinolin-8-yl-2-N-(2,3,4-trifluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109144098
N-quinolin-8-ylcyclohexanecarboxamide
CID 835933
N-(2-methylphenyl)-2-(piperidine-1-carbonyl)cyclopropane-1-carboxamide
CID 109132258
2-N,3-N-di(quinolin-8-yl)bicyclo[2.2.1]heptane-2,3-dicarboxamide
CID 135023876
2-N-[(2-fluorophenyl)methyl]-1-N-quinolin-8-ylcyclopropane-1,2-dicarboxamide
CID 109135997
2-(azepane-1-carbonyl)-N-(2-ethylphenyl)cyclopropane-1-carboxamide
CID 109140690
1-N-benzyl-1-N-methyl-2-N-quinolin-8-ylcyclopropane-1,2-dicarboxamide
CID 109135854
N-quinolin-8-ylpiperidine-2-carboxamide
CID 18071566

Frequently Asked Questions

What is the IUPAC name of 2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide?
The IUPAC name of 2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide (CID 109131957) is 2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide.
What is the SMILES notation for 2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide?
The canonical SMILES for 2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide is O=C(Nc1cccc2cccnc12)C1CC1C(=O)N1CCCC1.
What is the InChIKey of 2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide?
The InChIKey is AHFIDLWOMXPTCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c22-17(13-11-14(13)18(23)21-9-1-2-10-21)20-15-7-3-5-12-6-4-8-19-16(12)15/h3-8,13-14H,1-2,9-11H2,(H,20,22).
What are the key properties of 2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide?
2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyrrolidine-1-carbonyl)-N-quinolin-8-ylcyclopropane-1-carboxamide is sourced from PubChem (CID 109131957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).