3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide

C15H18N4O — CID 63140174

IUPAC3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide
SMILESCCC1(C(=O)Nc2ccc3nccnc3c2)CCNC1
InChIInChI=1S/C15H18N4O/c1-2-15(5-6-16-10-15)14(20)19-11-3-4-12-13(9-11)18-8-7-17-12/h3-4,7-9,16H,2,5-6,10H2,1H3,(H,19,20)
InChIKeyJBUDHVUGCVHCPG-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.96
Rot. Bonds3

About 3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide

3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide (PubChem CID 63140174) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide
PubChem CID63140174
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide
SMILESCCC1(C(=O)Nc2ccc3nccnc3c2)CCNC1
InChIInChI=1S/C15H18N4O/c1-2-15(5-6-16-10-15)14(20)19-11-3-4-12-13(9-11)18-8-7-17-12/h3-4,7-9,16H,2,5-6,10H2,1H3,(H,19,20)
InChIKeyJBUDHVUGCVHCPG-UHFFFAOYSA-N
XLogP1.96
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-N-quinolin-6-ylpyrrolidine-3-carboxamide
CID 63141954
3-ethyl-N-(3-fluoro-4-hydroxyphenyl)pyrrolidine-3-carboxamide
CID 64782595
N-(4-bromo-3-methylphenyl)-3-ethylpyrrolidine-3-carboxamide
CID 63140591
(3S)-3-ethyl-N-(1H-indazol-5-yl)pyrrolidine-3-carboxamide
CID 95018921
3-ethyl-N-quinolin-3-ylpyrrolidine-3-carboxamide
CID 63139330
3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide
CID 55165902
N-(4-ethoxyphenyl)-3-ethylpyrrolidine-3-carboxamide
CID 63140867
3-ethyl-N-(4-methoxyphenyl)pyrrolidine-3-carboxamide
CID 63140483
3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide
CID 55166292
5-[(3-ethylpyrrolidine-3-carbonyl)amino]-2-fluorobenzoic acid
CID 63139894
4-ethyl-N-pyridin-4-ylpiperidine-4-carboxamide
CID 63127778
N-(2,3-dihydro-1H-inden-5-yl)-3-ethylpiperidine-3-carboxamide
CID 63132083

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide (CID 63140174) is 3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide is CCC1(C(=O)Nc2ccc3nccnc3c2)CCNC1.
What is the InChIKey of 3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide?
The InChIKey is JBUDHVUGCVHCPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-2-15(5-6-16-10-15)14(20)19-11-3-4-12-13(9-11)18-8-7-17-12/h3-4,7-9,16H,2,5-6,10H2,1H3,(H,19,20).
What are the key properties of 3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide?
3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 1.96, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63140174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).