N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide

C16H25N3O — CID 114546140

IUPACN-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide
SMILESCC1CCC(NC(=O)c2cccn2C2CCNCC2)C1
InChIInChI=1S/C16H25N3O/c1-12-4-5-13(11-12)18-16(20)15-3-2-10-19(15)14-6-8-17-9-7-14/h2-3,10,12-14,17H,4-9,11H2,1H3,(H,18,20)
InChIKeyMNHIPMNCSSNYOS-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.33
Rot. Bonds3

About N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide

N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide (PubChem CID 114546140) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide.

Molecular Properties

Compound NameN-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide
PubChem CID114546140
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide
SMILESCC1CCC(NC(=O)c2cccn2C2CCNCC2)C1
InChIInChI=1S/C16H25N3O/c1-12-4-5-13(11-12)18-16(20)15-3-2-10-19(15)14-6-8-17-9-7-14/h2-3,10,12-14,17H,4-9,11H2,1H3,(H,18,20)
InChIKeyMNHIPMNCSSNYOS-UHFFFAOYSA-N
XLogP2.33
TPSA46.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylcyclopropyl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 103811287
(3,5-dimethylpiperidin-1-yl)-(1-piperidin-4-ylpyrrol-2-yl)methanone
CID 62716093
N-(2-chloroprop-2-enyl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 115739736
2-methyl-2-[(1-piperidin-4-ylpyrrole-2-carbonyl)amino]propanoic acid
CID 62715245
N-(2-ethylsulfonylethyl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 103810373
N-(3-methylpentan-3-yl)-1-piperidin-4-ylpyrrole-2-carboxamide
CID 106328568
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
1-piperidin-4-yl-N-(1H-pyrazol-5-yl)pyrrole-2-carboxamide
CID 62715754
cyclopropyl-(1-piperidin-4-ylpyrrol-2-yl)methanone
CID 116564829
N-[3-(hydroxymethyl)pentan-3-yl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 62715939
N-[(2,2-dimethylcyclopropyl)methyl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 103811345

Frequently Asked Questions

What is the IUPAC name of N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide?
The IUPAC name of N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide (CID 114546140) is N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide.
What is the SMILES notation for N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide?
The canonical SMILES for N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide is CC1CCC(NC(=O)c2cccn2C2CCNCC2)C1.
What is the InChIKey of N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide?
The InChIKey is MNHIPMNCSSNYOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-12-4-5-13(11-12)18-16(20)15-3-2-10-19(15)14-6-8-17-9-7-14/h2-3,10,12-14,17H,4-9,11H2,1H3,(H,18,20).
What are the key properties of N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide?
N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcyclopentyl)-1-piperidin-4-ylpyrrole-2-carboxamide is sourced from PubChem (CID 114546140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).