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

C20H35N3O2 — CID 46381867

IUPACN-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide
SMILESO=C(NCCC1CCN(C(=O)NC2CCCCC2)CC1)C1CCCC1
InChIInChI=1S/C20H35N3O2/c24-19(17-6-4-5-7-17)21-13-10-16-11-14-23(15-12-16)20(25)22-18-8-2-1-3-9-18/h16-18H,1-15H2,(H,21,24)(H,22,25)
InChIKeyMJYQUEQUEICQEZ-UHFFFAOYSA-N
MW349.52 g/mol
LogP3.44
Rot. Bonds5

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

N-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide (PubChem CID 46381867) has the molecular formula C20H35N3O2 and a molecular weight of 349.52 g/mol. Its IUPAC name is N-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide
PubChem CID46381867
Molecular FormulaC20H35N3O2
Molecular Weight349.52 g/mol
Exact Mass349.27
IUPAC NameN-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide
SMILESO=C(NCCC1CCN(C(=O)NC2CCCCC2)CC1)C1CCCC1
InChIInChI=1S/C20H35N3O2/c24-19(17-6-4-5-7-17)21-13-10-16-11-14-23(15-12-16)20(25)22-18-8-2-1-3-9-18/h16-18H,1-15H2,(H,21,24)(H,22,25)
InChIKeyMJYQUEQUEICQEZ-UHFFFAOYSA-N
XLogP3.44
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.52
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide (CID 46381867) is N-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide is O=C(NCCC1CCN(C(=O)NC2CCCCC2)CC1)C1CCCC1.
What is the InChIKey of N-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide?
The InChIKey is MJYQUEQUEICQEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H35N3O2/c24-19(17-6-4-5-7-17)21-13-10-16-11-14-23(15-12-16)20(25)22-18-8-2-1-3-9-18/h16-18H,1-15H2,(H,21,24)(H,22,25).
What are the key properties of N-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide?
N-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide has a molecular weight of 349.52 g/mol, XLogP of 3.44, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-[2-(cyclopentanecarbonylamino)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 46381867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).