N-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide

C24H43N3O2 — CID 3220907

IUPACN-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC1CCN(CC(=O)N(C2CCCCC2)C2CCCCC2)CC1
InChIInChI=1S/C24H43N3O2/c1-24(2,3)23(29)25-19-14-16-26(17-15-19)18-22(28)27(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h19-21H,4-18H2,1-3H3,(H,25,29)
InChIKeyXECBYKWBSWUPBK-UHFFFAOYSA-N
MW405.63 g/mol
LogP4.11
Rot. Bonds5

About N-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide

N-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide (PubChem CID 3220907) has the molecular formula C24H43N3O2 and a molecular weight of 405.63 g/mol. Its IUPAC name is N-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide
PubChem CID3220907
Molecular FormulaC24H43N3O2
Molecular Weight405.63 g/mol
Exact Mass405.34
IUPAC NameN-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC1CCN(CC(=O)N(C2CCCCC2)C2CCCCC2)CC1
InChIInChI=1S/C24H43N3O2/c1-24(2,3)23(29)25-19-14-16-26(17-15-19)18-22(28)27(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h19-21H,4-18H2,1-3H3,(H,25,29)
InChIKeyXECBYKWBSWUPBK-UHFFFAOYSA-N
XLogP4.11
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.63
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide?
The IUPAC name of N-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide (CID 3220907) is N-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide is CC(C)(C)C(=O)NC1CCN(CC(=O)N(C2CCCCC2)C2CCCCC2)CC1.
What is the InChIKey of N-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide?
The InChIKey is XECBYKWBSWUPBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H43N3O2/c1-24(2,3)23(29)25-19-14-16-26(17-15-19)18-22(28)27(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h19-21H,4-18H2,1-3H3,(H,25,29).
What are the key properties of N-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide?
N-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide has a molecular weight of 405.63 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(dicyclohexylamino)-2-oxoethyl]piperidin-4-yl]-2,2-dimethylpropanamide is sourced from PubChem (CID 3220907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).