2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide

C13H25N3O2 — CID 51170715

IUPAC2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide
SMILESCCCNC(=O)NC(=O)CN1CC(C)CC(C)C1
InChIInChI=1S/C13H25N3O2/c1-4-5-14-13(18)15-12(17)9-16-7-10(2)6-11(3)8-16/h10-11H,4-9H2,1-3H3,(H2,14,15,17,18)
InChIKeyFFECFXSWVPMQLO-UHFFFAOYSA-N
MW255.36 g/mol
LogP1.20
Rot. Bonds4

About 2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide

2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide (PubChem CID 51170715) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide
PubChem CID51170715
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide
SMILESCCCNC(=O)NC(=O)CN1CC(C)CC(C)C1
InChIInChI=1S/C13H25N3O2/c1-4-5-14-13(18)15-12(17)9-16-7-10(2)6-11(3)8-16/h10-11H,4-9H2,1-3H3,(H2,14,15,17,18)
InChIKeyFFECFXSWVPMQLO-UHFFFAOYSA-N
XLogP1.20
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide
CID 8903288
2-(3-amino-4-methylpyrrolidin-1-yl)-N-(propylcarbamoyl)acetamide
CID 103576948
N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-(3,5-dimethylpiperidin-1-yl)acetamide
CID 18084867
2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-N-(propylcarbamoyl)acetamide
CID 112628199
2-[3-(aminomethyl)pyrrolidin-1-yl]-N-(propylcarbamoyl)acetamide
CID 62064117
2-(4-formylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide
CID 62654269
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-(ethylcarbamoyl)acetamide
CID 25376066
2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 8904767
2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-N-(phenylcarbamoyl)acetamide
CID 8540742
2-(3-aminoazetidin-1-yl)-N-(ethylcarbamoyl)acetamide
CID 65249628
2-(3,4-dihydroxypyrrolidin-1-yl)-N-(3-methylbutylcarbamoyl)acetamide
CID 106672699
2-(1,4-diazepan-1-yl)-N-(propylcarbamoyl)acetamide;hydrochloride
CID 119906348

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide?
The IUPAC name of 2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide (CID 51170715) is 2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide.
What is the SMILES notation for 2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide?
The canonical SMILES for 2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide is CCCNC(=O)NC(=O)CN1CC(C)CC(C)C1.
What is the InChIKey of 2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide?
The InChIKey is FFECFXSWVPMQLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-4-5-14-13(18)15-12(17)9-16-7-10(2)6-11(3)8-16/h10-11H,4-9H2,1-3H3,(H2,14,15,17,18).
What are the key properties of 2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide?
2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide has a molecular weight of 255.36 g/mol, XLogP of 1.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide is sourced from PubChem (CID 51170715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).