N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide

C13H25N3O — CID 63715986

IUPACN-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide
SMILESCCN1CCC(NC(=O)C2CNCC2C)CC1
InChIInChI=1S/C13H25N3O/c1-3-16-6-4-11(5-7-16)15-13(17)12-9-14-8-10(12)2/h10-12,14H,3-9H2,1-2H3,(H,15,17)
InChIKeyJOWOOPQJDMHKBZ-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.44
Rot. Bonds3

About N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide

N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide (PubChem CID 63715986) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide
PubChem CID63715986
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC NameN-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide
SMILESCCN1CCC(NC(=O)C2CNCC2C)CC1
InChIInChI=1S/C13H25N3O/c1-3-16-6-4-11(5-7-16)15-13(17)12-9-14-8-10(12)2/h10-12,14H,3-9H2,1-2H3,(H,15,17)
InChIKeyJOWOOPQJDMHKBZ-UHFFFAOYSA-N
XLogP0.44
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 ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide
CID 55228814
(3S,4S)-4-methyl-N-(1-methylazetidin-3-yl)pyrrolidine-3-carboxamide
CID 131204171
4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide
CID 63714005
(3S,4S)-N-(4,4-dimethylcyclohexyl)-4-methylpyrrolidine-3-carboxamide
CID 114084930
N-(1-ethylpiperidin-4-yl)-N,4-dimethylpyrrolidine-3-carboxamide
CID 55229194
4-[(4-methylpyrrolidine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 63715319
4-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidine-3-carboxamide
CID 63713938
2-amino-N-(1-ethylpiperidin-4-yl)cyclopentane-1-carboxamide
CID 64824596
N-cyclopent-3-en-1-yl-4-methylpyrrolidine-3-carboxamide
CID 115976512
(3S,4S)-N-cyclopent-3-en-1-yl-4-methylpyrrolidine-3-carboxamide;hydrochloride
CID 131110722
4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide
CID 66238269
(1-ethylpiperidin-4-yl)carbamic acid;hydrochloride
CID 68989076

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide (CID 63715986) is N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide is CCN1CCC(NC(=O)C2CNCC2C)CC1.
What is the InChIKey of N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide?
The InChIKey is JOWOOPQJDMHKBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-3-16-6-4-11(5-7-16)15-13(17)12-9-14-8-10(12)2/h10-12,14H,3-9H2,1-2H3,(H,15,17).
What are the key properties of N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide?
N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63715986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).