N-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide

C20H36N4O2 — CID 46381823

IUPACN-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide
SMILESO=C(NCCC1CCN(C(=O)NC2CCCCC2)CC1)NC1CCCC1
InChIInChI=1S/C20H36N4O2/c25-19(22-17-8-4-5-9-17)21-13-10-16-11-14-24(15-12-16)20(26)23-18-6-2-1-3-7-18/h16-18H,1-15H2,(H,23,26)(H2,21,22,25)
InChIKeyMFEFRXRDUOZTTM-UHFFFAOYSA-N
MW364.53 g/mol
LogP3.37
Rot. Bonds5

About N-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide

N-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide (PubChem CID 46381823) has the molecular formula C20H36N4O2 and a molecular weight of 364.53 g/mol. Its IUPAC name is N-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide
PubChem CID46381823
Molecular FormulaC20H36N4O2
Molecular Weight364.53 g/mol
Exact Mass364.28
IUPAC NameN-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide
SMILESO=C(NCCC1CCN(C(=O)NC2CCCCC2)CC1)NC1CCCC1
InChIInChI=1S/C20H36N4O2/c25-19(22-17-8-4-5-9-17)21-13-10-16-11-14-24(15-12-16)20(26)23-18-6-2-1-3-7-18/h16-18H,1-15H2,(H,23,26)(H2,21,22,25)
InChIKeyMFEFRXRDUOZTTM-UHFFFAOYSA-N
XLogP3.37
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.53
LogP ≤ 53.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide (CID 46381823) is N-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide is O=C(NCCC1CCN(C(=O)NC2CCCCC2)CC1)NC1CCCC1.
What is the InChIKey of N-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide?
The InChIKey is MFEFRXRDUOZTTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H36N4O2/c25-19(22-17-8-4-5-9-17)21-13-10-16-11-14-24(15-12-16)20(26)23-18-6-2-1-3-7-18/h16-18H,1-15H2,(H,23,26)(H2,21,22,25).
What are the key properties of N-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide?
N-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide has a molecular weight of 364.53 g/mol, XLogP of 3.37, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-[2-(cyclopentylcarbamoylamino)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 46381823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).