2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide

C13H25N3O — CID 83071438

IUPAC2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide
SMILESCCC1(C(=O)NC2CCCN(C)C2)CCCN1
InChIInChI=1S/C13H25N3O/c1-3-13(7-5-8-14-13)12(17)15-11-6-4-9-16(2)10-11/h11,14H,3-10H2,1-2H3,(H,15,17)
InChIKeyUDJJRWIBLOXJGR-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.73
Rot. Bonds3

About 2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide

2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide (PubChem CID 83071438) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide
PubChem CID83071438
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide
SMILESCCC1(C(=O)NC2CCCN(C)C2)CCCN1
InChIInChI=1S/C13H25N3O/c1-3-13(7-5-8-14-13)12(17)15-11-6-4-9-16(2)10-11/h11,14H,3-10H2,1-2H3,(H,15,17)
InChIKeyUDJJRWIBLOXJGR-UHFFFAOYSA-N
XLogP0.73
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-N-(1-methyl-6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide
CID 83071553
2-ethyl-N-(1-ethylpiperidin-4-yl)pyrrolidine-2-carboxamide
CID 83071590
N-(azetidin-3-yl)-2-ethylpyrrolidine-2-carboxamide;hydrochloride
CID 130637882
N-(1-butylpiperidin-4-yl)-2-ethylpyrrolidine-2-carboxamide
CID 83071563
3-ethyl-N-(1-methylpiperidin-3-yl)piperidine-3-carboxamide
CID 63135196
3-[(2-ethylpyrrolidine-2-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 83071541
2-[(2-ethylpyrrolidine-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 83072401
N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethylpyrrolidine-2-carboxamide
CID 107163864
2-ethyl-N-(2-methylsulfanylcyclohexyl)pyrrolidine-2-carboxamide
CID 114123001
cyclopropyl-(2-ethylpyrrolidin-2-yl)methanone
CID 116608291
N-(2,6-dimethylpiperidin-1-yl)-2-ethylpyrrolidine-2-carboxamide
CID 83074390
methyl 2-[(1-methylpiperidin-3-yl)methyl]piperidine-2-carboxylate
CID 115103685

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide?
The IUPAC name of 2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide (CID 83071438) is 2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for 2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide is CCC1(C(=O)NC2CCCN(C)C2)CCCN1.
What is the InChIKey of 2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide?
The InChIKey is UDJJRWIBLOXJGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-3-13(7-5-8-14-13)12(17)15-11-6-4-9-16(2)10-11/h11,14H,3-10H2,1-2H3,(H,15,17).
What are the key properties of 2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide?
2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 0.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 83071438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).