1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide

C15H21N5O — CID 62716104

IUPAC1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide
SMILESO=C(NCCn1cccn1)c1cccn1C1CCNCC1
InChIInChI=1S/C15H21N5O/c21-15(17-9-12-19-10-2-6-18-19)14-3-1-11-20(14)13-4-7-16-8-5-13/h1-3,6,10-11,13,16H,4-5,7-9,12H2,(H,17,21)
InChIKeyRVECZOBMGGSTNP-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.04
Rot. Bonds5

About 1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide

1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide (PubChem CID 62716104) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide.

Molecular Properties

Compound Name1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide
PubChem CID62716104
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide
SMILESO=C(NCCn1cccn1)c1cccn1C1CCNCC1
InChIInChI=1S/C15H21N5O/c21-15(17-9-12-19-10-2-6-18-19)14-3-1-11-20(14)13-4-7-16-8-5-13/h1-3,6,10-11,13,16H,4-5,7-9,12H2,(H,17,21)
InChIKeyRVECZOBMGGSTNP-UHFFFAOYSA-N
XLogP1.04
TPSA63.88 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethylsulfonylethyl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 103810373
N-hex-5-ynyl-1-piperidin-4-ylpyrrole-2-carboxamide
CID 106213127
N-(2-chloroprop-2-enyl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 115739736
N-[(2S)-2-hydroxypropyl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 107221129
N-[2-(cyclopenten-1-yl)ethyl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 106175020
1-piperidin-4-yl-N-(3-propan-2-yloxypropyl)pyrrole-2-carboxamide
CID 62715930
1-cyclopropyl-N-ethylpyrrole-2-carboxamide
CID 130688583
N-[2-(6-methyl-3-pyridinyl)ethyl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 91645696
1-piperidin-4-yl-N-(4-pyrazol-1-ylphenyl)pyrrole-2-carboxamide
CID 86770861
1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrolidine-2-carboxamide
CID 61460772
N-[(1-methylpyrrol-3-yl)methyl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 103814714
N-[(2,2-dimethylcyclopropyl)methyl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 103811345

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide?
The IUPAC name of 1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide (CID 62716104) is 1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide.
What is the SMILES notation for 1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide?
The canonical SMILES for 1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide is O=C(NCCn1cccn1)c1cccn1C1CCNCC1.
What is the InChIKey of 1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide?
The InChIKey is RVECZOBMGGSTNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c21-15(17-9-12-19-10-2-6-18-19)14-3-1-11-20(14)13-4-7-16-8-5-13/h1-3,6,10-11,13,16H,4-5,7-9,12H2,(H,17,21).
What are the key properties of 1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide?
1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide has a molecular weight of 287.37 g/mol, XLogP of 1.04, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide is sourced from PubChem (CID 62716104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).