N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide

C15H23N3O — CID 103811287

IUPACN-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide
SMILESCCC1CC1NC(=O)c1cccn1C1CCNCC1
InChIInChI=1S/C15H23N3O/c1-2-11-10-13(11)17-15(19)14-4-3-9-18(14)12-5-7-16-8-6-12/h3-4,9,11-13,16H,2,5-8,10H2,1H3,(H,17,19)
InChIKeyIZEBBYIWFPRLBO-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.94
Rot. Bonds4

About N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide

N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide (PubChem CID 103811287) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide
PubChem CID103811287
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide
SMILESCCC1CC1NC(=O)c1cccn1C1CCNCC1
InChIInChI=1S/C15H23N3O/c1-2-11-10-13(11)17-15(19)14-4-3-9-18(14)12-5-7-16-8-6-12/h3-4,9,11-13,16H,2,5-8,10H2,1H3,(H,17,19)
InChIKeyIZEBBYIWFPRLBO-UHFFFAOYSA-N
XLogP1.94
TPSA46.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 114546140
N-[3-(hydroxymethyl)pentan-3-yl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 62715939
N-(3-methylpentan-3-yl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 106328568
N-(2-chloroprop-2-enyl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 115739736
N-(2-ethylsulfonylethyl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 103810373
N-[(2S)-2-hydroxypropyl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 107221129
N-(1-hydroxy-2-methylpropan-2-yl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 62715225
2-methyl-2-[(1-piperidin-4-ylpyrrole-2-carbonyl)amino]propanoic acid
CID 62715245
N-[(2,2-dimethylcyclopropyl)methyl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 103811345
3-methyl-1-(1-piperidin-4-ylpyrrol-2-yl)but-3-en-1-one
CID 116564816
1-piperidin-4-yl-N-(2,3,3-trimethylbutyl)pyrrole-2-carboxamide
CID 81494193
1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide
CID 62716104

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide?
The IUPAC name of N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide (CID 103811287) is N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide.
What is the SMILES notation for N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide?
The canonical SMILES for N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide is CCC1CC1NC(=O)c1cccn1C1CCNCC1.
What is the InChIKey of N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide?
The InChIKey is IZEBBYIWFPRLBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-2-11-10-13(11)17-15(19)14-4-3-9-18(14)12-5-7-16-8-6-12/h3-4,9,11-13,16H,2,5-8,10H2,1H3,(H,17,19).
What are the key properties of N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide?
N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide is sourced from PubChem (CID 103811287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).