1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide

C20H32N4O2 — CID 72898854

IUPAC1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide
SMILESCN(CCCc1nccn1C)C(=O)C1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C20H32N4O2/c1-22-15-11-21-18(22)8-5-12-23(2)19(25)17-9-13-24(14-10-17)20(26)16-6-3-4-7-16/h11,15-17H,3-10,12-14H2,1-2H3
InChIKeyOSAIUKXPTVZKNM-UHFFFAOYSA-N
MW360.50 g/mol
LogP2.24
Rot. Bonds6

About 1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide

1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide (PubChem CID 72898854) has the molecular formula C20H32N4O2 and a molecular weight of 360.50 g/mol. Its IUPAC name is 1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide
PubChem CID72898854
Molecular FormulaC20H32N4O2
Molecular Weight360.50 g/mol
Exact Mass360.25
IUPAC Name1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide
SMILESCN(CCCc1nccn1C)C(=O)C1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C20H32N4O2/c1-22-15-11-21-18(22)8-5-12-23(2)19(25)17-9-13-24(14-10-17)20(26)16-6-3-4-7-16/h11,15-17H,3-10,12-14H2,1-2H3
InChIKeyOSAIUKXPTVZKNM-UHFFFAOYSA-N
XLogP2.24
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.50
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide?
The IUPAC name of 1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide (CID 72898854) is 1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide is CN(CCCc1nccn1C)C(=O)C1CCN(C(=O)C2CCCC2)CC1.
What is the InChIKey of 1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide?
The InChIKey is OSAIUKXPTVZKNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N4O2/c1-22-15-11-21-18(22)8-5-12-23(2)19(25)17-9-13-24(14-10-17)20(26)16-6-3-4-7-16/h11,15-17H,3-10,12-14H2,1-2H3.
What are the key properties of 1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide?
1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide has a molecular weight of 360.50 g/mol, XLogP of 2.24, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentanecarbonyl)-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]piperidine-4-carboxamide is sourced from PubChem (CID 72898854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).