2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide

C16H24N4O2 — CID 167763974

IUPAC2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide
SMILESCn1cc(C(N)=O)cc1C(=O)NC1CCN(C2CCCC2)C1
InChIInChI=1S/C16H24N4O2/c1-19-9-11(15(17)21)8-14(19)16(22)18-12-6-7-20(10-12)13-4-2-3-5-13/h8-9,12-13H,2-7,10H2,1H3,(H2,17,21)(H,18,22)
InChIKeyYSBNQBZQPLMOTP-UHFFFAOYSA-N
MW304.39 g/mol
LogP0.87
Rot. Bonds4

About 2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide

2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide (PubChem CID 167763974) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide
PubChem CID167763974
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC Name2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide
SMILESCn1cc(C(N)=O)cc1C(=O)NC1CCN(C2CCCC2)C1
InChIInChI=1S/C16H24N4O2/c1-19-9-11(15(17)21)8-14(19)16(22)18-12-6-7-20(10-12)13-4-2-3-5-13/h8-9,12-13H,2-7,10H2,1H3,(H2,17,21)(H,18,22)
InChIKeyYSBNQBZQPLMOTP-UHFFFAOYSA-N
XLogP0.87
TPSA80.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-[2-(aminomethyl)cyclohexyl]-1-methylpyrrole-2,4-dicarboxamide
CID 119612147
2-N-[2-(cycloheptylamino)ethyl]-1-methylpyrrole-2,4-dicarboxamide;hydrochloride
CID 119621202
2-N-[2-(aminomethyl)cyclohexyl]-1-methylpyrrole-2,4-dicarboxamide;hydrochloride
CID 119612146
4-amino-1-methyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide
CID 61461789
4-amino-1-methyl-N-(1-methylpiperidin-4-yl)pyrrole-2-carboxamide
CID 43643546
5-amino-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrazole-4-carboxamide
CID 110485291
4-[[[N-(1-cyclopentylpyrrolidin-3-yl)-N'-methylcarbamimidoyl]amino]methyl]benzamide
CID 111920075
2,4-dichloro-N-(1-cyclohexylpyrrolidin-3-yl)benzamide
CID 12898848
N-[(3S)-1-cycloheptylpyrrolidin-3-yl]-2,5-difluorobenzamide
CID 52860014
N-(1-cyclopropylpiperidin-4-yl)-1-methyl-4-pyrrolidin-1-ylsulfonylpyrrole-2-carboxamide
CID 55560394
4-amino-3,5-dichloro-N-(1-cyclopropylpyrrolidin-3-yl)benzamide
CID 82833146
4-amino-1-methyl-N-(1-methylsulfonylpiperidin-4-yl)pyrrole-2-carboxamide
CID 43644159

Frequently Asked Questions

What is the IUPAC name of 2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide?
The IUPAC name of 2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide (CID 167763974) is 2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide?
The canonical SMILES for 2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide is Cn1cc(C(N)=O)cc1C(=O)NC1CCN(C2CCCC2)C1.
What is the InChIKey of 2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide?
The InChIKey is YSBNQBZQPLMOTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-19-9-11(15(17)21)8-14(19)16(22)18-12-6-7-20(10-12)13-4-2-3-5-13/h8-9,12-13H,2-7,10H2,1H3,(H2,17,21)(H,18,22).
What are the key properties of 2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide?
2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide has a molecular weight of 304.39 g/mol, XLogP of 0.87, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrrole-2,4-dicarboxamide is sourced from PubChem (CID 167763974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).