3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide

C15H22N2O — CID 55165902

IUPAC3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide
SMILESCCc1cccc(NC(=O)C2(CC)CCNC2)c1
InChIInChI=1S/C15H22N2O/c1-3-12-6-5-7-13(10-12)17-14(18)15(4-2)8-9-16-11-15/h5-7,10,16H,3-4,8-9,11H2,1-2H3,(H,17,18)
InChIKeyQYLVCXZJKBUCGC-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.58
Rot. Bonds4

About 3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide

3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide (PubChem CID 55165902) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide
PubChem CID55165902
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide
SMILESCCc1cccc(NC(=O)C2(CC)CCNC2)c1
InChIInChI=1S/C15H22N2O/c1-3-12-6-5-7-13(10-12)17-14(18)15(4-2)8-9-16-11-15/h5-7,10,16H,3-4,8-9,11H2,1-2H3,(H,17,18)
InChIKeyQYLVCXZJKBUCGC-UHFFFAOYSA-N
XLogP2.58
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-[(4-ethylpiperidine-4-carbonyl)amino]phenyl]acetic acid
CID 65350521
3-ethyl-N-[3-(sulfamoylamino)phenyl]pyrrolidine-3-carboxamide
CID 63139750
N-(3-bromophenyl)-3-ethylpiperidine-3-carboxamide
CID 63132260
3-[(3-ethylpiperidine-3-carbonyl)amino]benzoic acid
CID 63131356
N-(3-ethylphenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119675705
3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide
CID 55166292
4-ethyl-N-(4-ethylphenyl)piperidine-4-carboxamide
CID 63127797
N-(3-bromophenyl)-3-propylpyrrolidine-3-carboxamide
CID 55164937
3-ethyl-N-(3-fluoro-4-hydroxyphenyl)pyrrolidine-3-carboxamide
CID 64782595
N-(4-bromo-3-methylphenyl)-3-ethylpyrrolidine-3-carboxamide
CID 63140591
3-ethyl-N-(3-sulfamoylphenyl)piperidine-3-carboxamide
CID 63132301
3-ethyl-N-quinoxalin-6-ylpyrrolidine-3-carboxamide
CID 63140174

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide (CID 55165902) is 3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide is CCc1cccc(NC(=O)C2(CC)CCNC2)c1.
What is the InChIKey of 3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide?
The InChIKey is QYLVCXZJKBUCGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-3-12-6-5-7-13(10-12)17-14(18)15(4-2)8-9-16-11-15/h5-7,10,16H,3-4,8-9,11H2,1-2H3,(H,17,18).
What are the key properties of 3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide?
3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide has a molecular weight of 246.35 g/mol, XLogP of 2.58, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(3-ethylphenyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 55165902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).