2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide

C11H22N4O2 — CID 115313018

IUPAC2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)N1CCC(N)CC1C
InChIInChI=1S/C11H22N4O2/c1-7-6-9(12)4-5-15(7)8(2)10(16)14-11(17)13-3/h7-9H,4-6,12H2,1-3H3,(H2,13,14,16,17)
InChIKeyMDTDMJPOHNHFGL-UHFFFAOYSA-N
MW242.32 g/mol
LogP-0.36
Rot. Bonds2

About 2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide

2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide (PubChem CID 115313018) has the molecular formula C11H22N4O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide
PubChem CID115313018
Molecular FormulaC11H22N4O2
Molecular Weight242.32 g/mol
Exact Mass242.17
IUPAC Name2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)N1CCC(N)CC1C
InChIInChI=1S/C11H22N4O2/c1-7-6-9(12)4-5-15(7)8(2)10(16)14-11(17)13-3/h7-9H,4-6,12H2,1-3H3,(H2,13,14,16,17)
InChIKeyMDTDMJPOHNHFGL-UHFFFAOYSA-N
XLogP-0.36
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-0.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-amino-2-methylpiperidin-1-yl)-N-propylpropanamide
CID 115313029
2-(3-aminoazetidin-1-yl)-N-(methylcarbamoyl)propanamide
CID 63761122
2-methyl-1-[1-(methylamino)-1-oxopropan-2-yl]piperidine-4-carboxylic acid
CID 106744633
1-[1-(methylcarbamoylamino)-1-oxopropan-2-yl]piperidine-2-carboxylic acid
CID 43440976
2-(4-amino-3-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide
CID 79867465
2-(2,4-dimethylpiperidin-1-yl)propanehydrazide
CID 63572213
2-[1-[1-(methylcarbamoylamino)-1-oxopropan-2-yl]piperidin-2-yl]acetic acid
CID 54899679
2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide
CID 60820303
2-(3,5-dimethylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide
CID 51170713
2-[2-(3-hydroxypropyl)pyrrolidin-1-yl]-N-(methylcarbamoyl)propanamide
CID 62469409
tert-butyl (2S)-1-[1-(methylcarbamoylamino)-1-oxopropan-2-yl]pyrrolidine-2-carboxylate
CID 115537272
2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-(methylcarbamoyl)propanamide
CID 81217822

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide?
The IUPAC name of 2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide (CID 115313018) is 2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide.
What is the SMILES notation for 2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide?
The canonical SMILES for 2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide is CNC(=O)NC(=O)C(C)N1CCC(N)CC1C.
What is the InChIKey of 2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide?
The InChIKey is MDTDMJPOHNHFGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O2/c1-7-6-9(12)4-5-15(7)8(2)10(16)14-11(17)13-3/h7-9H,4-6,12H2,1-3H3,(H2,13,14,16,17).
What are the key properties of 2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide?
2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide has a molecular weight of 242.32 g/mol, XLogP of -0.36, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-2-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide is sourced from PubChem (CID 115313018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).