N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide

C21H37N3O3 — CID 38289278

IUPACN-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide
SMILESC[C@@H]1CN(C(=O)C2CCN(C(=O)NC3CCCCCCC3)CC2)C[C@@H](C)O1
InChIInChI=1S/C21H37N3O3/c1-16-14-24(15-17(2)27-16)20(25)18-10-12-23(13-11-18)21(26)22-19-8-6-4-3-5-7-9-19/h16-19H,3-15H2,1-2H3,(H,22,26)/t16-,17-/m1/s1
InChIKeyQSGIYIAKVAKESE-IAGOWNOFSA-N
MW379.55 g/mol
LogP3.16
Rot. Bonds2

About N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide

N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide (PubChem CID 38289278) has the molecular formula C21H37N3O3 and a molecular weight of 379.55 g/mol. Its IUPAC name is N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide
PubChem CID38289278
Molecular FormulaC21H37N3O3
Molecular Weight379.55 g/mol
Exact Mass379.28
IUPAC NameN-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide
SMILESC[C@@H]1CN(C(=O)C2CCN(C(=O)NC3CCCCCCC3)CC2)C[C@@H](C)O1
InChIInChI=1S/C21H37N3O3/c1-16-14-24(15-17(2)27-16)20(25)18-10-12-23(13-11-18)21(26)22-19-8-6-4-3-5-7-9-19/h16-19H,3-15H2,1-2H3,(H,22,26)/t16-,17-/m1/s1
InChIKeyQSGIYIAKVAKESE-IAGOWNOFSA-N
XLogP3.16
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.55
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cyclohexyl-(2,6-dimethylmorpholin-4-yl)methanone
CID 2915019
N-cyclopentyl-2-[4-(2,6-dimethylmorpholine-4-carbonyl)piperidin-1-yl]propanamide
CID 55832685
N-cyclohexyl-4-(cyclopentanecarbonyl)piperazine-1-carboxamide
CID 110364760
N-cyclohexyl-4-(4-ethylpiperazine-1-carbonyl)piperidine-1-carboxamide
CID 113003723
N-cycloheptylpiperidine-1-carboxamide
CID 54054704
(3R)-N-cyclohexyl-3-methylpyrrolidine-1-carboxamide
CID 66581198
methyl 1-(cyclohexylcarbamoyl)piperidine-4-carboxylate
CID 894690
N-cyclohexyl-2-(2,6-dimethylmorpholin-4-yl)-2-oxoacetamide
CID 108503876
4-cyclohexyl-1-[4-(2,6-dimethylmorpholine-4-carbonyl)piperidin-1-yl]butan-1-one
CID 55673832
4-(2,6-dimethylmorpholine-4-carbonyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide
CID 51118494
(3S,5S)-N-cyclohexyl-3,5-dimethylpiperidine-1-carboxamide
CID 1332142
1-[1-(cyclopentylcarbamoyl)piperidine-3-carbonyl]pyrrolidine-3-carboxylic acid
CID 119353705

Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide?
The IUPAC name of N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide (CID 38289278) is N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide.
What is the SMILES notation for N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide?
The canonical SMILES for N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide is C[C@@H]1CN(C(=O)C2CCN(C(=O)NC3CCCCCCC3)CC2)C[C@@H](C)O1.
What is the InChIKey of N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide?
The InChIKey is QSGIYIAKVAKESE-IAGOWNOFSA-N. The full InChI is InChI=1S/C21H37N3O3/c1-16-14-24(15-17(2)27-16)20(25)18-10-12-23(13-11-18)21(26)22-19-8-6-4-3-5-7-9-19/h16-19H,3-15H2,1-2H3,(H,22,26)/t16-,17-/m1/s1.
What are the key properties of N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide?
N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide has a molecular weight of 379.55 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide is sourced from PubChem (CID 38289278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).