N-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide

C15H23N3O2 — CID 62716770

IUPACN-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide
SMILESO=C(NCC1CCCO1)c1cccn1C1CCNCC1
InChIInChI=1S/C15H23N3O2/c19-15(17-11-13-3-2-10-20-13)14-4-1-9-18(14)12-5-7-16-8-6-12/h1,4,9,12-13,16H,2-3,5-8,10-11H2,(H,17,19)
InChIKeyYFARCORYCUOOEP-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.32
Rot. Bonds4

About N-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide

N-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide (PubChem CID 62716770) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide
PubChem CID62716770
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide
SMILESO=C(NCC1CCCO1)c1cccn1C1CCNCC1
InChIInChI=1S/C15H23N3O2/c19-15(17-11-13-3-2-10-20-13)14-4-1-9-18(14)12-5-7-16-8-6-12/h1,4,9,12-13,16H,2-3,5-8,10-11H2,(H,17,19)
InChIKeyYFARCORYCUOOEP-UHFFFAOYSA-N
XLogP1.32
TPSA55.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2,2-dimethylcyclopropyl)methyl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 103811345
N-[(2S)-2-hydroxypropyl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 107221129
N-(furan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 62716089
1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)pyrrole-2-carboxamide
CID 62541280
N-[(1-methylpyrrol-3-yl)methyl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 103814714
N-(2-methyl-2-methylsulfanylpropyl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 115739845
1-piperidin-4-yl-N-(2-pyrazol-1-ylethyl)pyrrole-2-carboxamide
CID 62716104
1-piperidin-4-yl-N-(2,3,3-trimethylbutyl)pyrrole-2-carboxamide
CID 81494193
N-[2-(cyclopenten-1-yl)ethyl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 106175020
N-hex-5-ynyl-1-piperidin-4-ylpyrrole-2-carboxamide
CID 106213127
N-[3-(hydroxymethyl)pentan-3-yl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 62715939
N-(1-hydroxy-2-methylpropan-2-yl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 62715225

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide?
The IUPAC name of N-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide (CID 62716770) is N-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide is O=C(NCC1CCCO1)c1cccn1C1CCNCC1.
What is the InChIKey of N-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide?
The InChIKey is YFARCORYCUOOEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c19-15(17-11-13-3-2-10-20-13)14-4-1-9-18(14)12-5-7-16-8-6-12/h1,4,9,12-13,16H,2-3,5-8,10-11H2,(H,17,19).
What are the key properties of N-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide?
N-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)-1-piperidin-4-ylpyrrole-2-carboxamide is sourced from PubChem (CID 62716770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).