3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide

C14H25N3O4 — CID 114778938

IUPAC3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide
SMILESCC1(C)CN(C(=O)C2CCCN(C(N)=O)C2)CC(CO)O1
InChIInChI=1S/C14H25N3O4/c1-14(2)9-17(7-11(8-18)21-14)12(19)10-4-3-5-16(6-10)13(15)20/h10-11,18H,3-9H2,1-2H3,(H2,15,20)
InChIKeyNRQMVHIAOJZDJV-UHFFFAOYSA-N
MW299.37 g/mol
LogP-0.22
Rot. Bonds2

About 3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide

3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide (PubChem CID 114778938) has the molecular formula C14H25N3O4 and a molecular weight of 299.37 g/mol. Its IUPAC name is 3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide
PubChem CID114778938
Molecular FormulaC14H25N3O4
Molecular Weight299.37 g/mol
Exact Mass299.18
IUPAC Name3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide
SMILESCC1(C)CN(C(=O)C2CCCN(C(N)=O)C2)CC(CO)O1
InChIInChI=1S/C14H25N3O4/c1-14(2)9-17(7-11(8-18)21-14)12(19)10-4-3-5-16(6-10)13(15)20/h10-11,18H,3-9H2,1-2H3,(H2,15,20)
InChIKeyNRQMVHIAOJZDJV-UHFFFAOYSA-N
XLogP-0.22
TPSA96.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3-aminocyclohexyl)-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
CID 114776790
6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbothioamide
CID 114776562
3-(4-hydroxy-4-methylpiperidine-1-carbonyl)piperidine-1-carboxamide
CID 80707295
3-[2-(hydroxymethyl)-5-methylmorpholine-4-carbonyl]piperidine-1-carboxamide
CID 81209250
[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-(thiolan-2-yl)methanone
CID 114778295
(2-amino-3-methylcyclohexyl)-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
CID 114780403
(2R)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]pyrrolidine-2-carboxylic acid
CID 104969896
[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-(6-methylpiperidin-2-yl)methanone
CID 114777052
3-(2-azaspiro[4.5]decane-2-carbonyl)piperidine-1-carboxamide
CID 71929504
N'-cyclopropyl-6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carboximidamide
CID 114780390
[1-(aminomethyl)cyclopentyl]-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
CID 114776550
[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-(3-methyloxolan-2-yl)methanone
CID 114778389

Frequently Asked Questions

What is the IUPAC name of 3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide?
The IUPAC name of 3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide (CID 114778938) is 3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide.
What is the SMILES notation for 3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide?
The canonical SMILES for 3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide is CC1(C)CN(C(=O)C2CCCN(C(N)=O)C2)CC(CO)O1.
What is the InChIKey of 3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide?
The InChIKey is NRQMVHIAOJZDJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O4/c1-14(2)9-17(7-11(8-18)21-14)12(19)10-4-3-5-16(6-10)13(15)20/h10-11,18H,3-9H2,1-2H3,(H2,15,20).
What are the key properties of 3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide?
3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide has a molecular weight of 299.37 g/mol, XLogP of -0.22, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]piperidine-1-carboxamide is sourced from PubChem (CID 114778938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).