3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide

C16H24N2O — CID 55166292

IUPAC3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide
SMILESCCCc1ccc(NC(=O)C2(CC)CCNC2)cc1
InChIInChI=1S/C16H24N2O/c1-3-5-13-6-8-14(9-7-13)18-15(19)16(4-2)10-11-17-12-16/h6-9,17H,3-5,10-12H2,1-2H3,(H,18,19)
InChIKeyYCYSHEISWXTTDJ-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.97
Rot. Bonds5

About 3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide

3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide (PubChem CID 55166292) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide
PubChem CID55166292
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide
SMILESCCCc1ccc(NC(=O)C2(CC)CCNC2)cc1
InChIInChI=1S/C16H24N2O/c1-3-5-13-6-8-14(9-7-13)18-15(19)16(4-2)10-11-17-12-16/h6-9,17H,3-5,10-12H2,1-2H3,(H,18,19)
InChIKeyYCYSHEISWXTTDJ-UHFFFAOYSA-N
XLogP2.97
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-N-(4-methoxyphenyl)pyrrolidine-3-carboxamide
CID 63140483
N-(4-ethoxyphenyl)-3-ethylpyrrolidine-3-carboxamide
CID 63140867
3-methyl-N-(4-propylphenyl)piperidine-3-carboxamide
CID 63130315
4-ethyl-N-(4-ethylphenyl)piperidine-4-carboxamide
CID 63127797
ethyl 4-[(3-ethylpyrrolidine-3-carbonyl)amino]benzoate
CID 63141450
3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide
CID 55165902
N-[4-(difluoromethylsulfanyl)phenyl]-3-ethylpyrrolidine-3-carboxamide
CID 63139535
N-(4-hydroxyphenyl)-3-propylpyrrolidine-3-carboxamide
CID 63139935
N-(4-bromo-3-methylphenyl)-3-ethylpyrrolidine-3-carboxamide
CID 63140591
3-ethyl-N-(3-fluoro-4-hydroxyphenyl)pyrrolidine-3-carboxamide
CID 64782595
3-ethyl-N-(6-oxo-1-propyl-3-pyridinyl)pyrrolidine-3-carboxamide
CID 63140353
3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide
CID 63140174

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide (CID 55166292) is 3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide is CCCc1ccc(NC(=O)C2(CC)CCNC2)cc1.
What is the InChIKey of 3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide?
The InChIKey is YCYSHEISWXTTDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-3-5-13-6-8-14(9-7-13)18-15(19)16(4-2)10-11-17-12-16/h6-9,17H,3-5,10-12H2,1-2H3,(H,18,19).
What are the key properties of 3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide?
3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 2.97, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 55166292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).