2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide

C11H22N4O2 — CID 60820303

IUPAC2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)N1CCC(NC)CC1
InChIInChI=1S/C11H22N4O2/c1-8(10(16)14-11(17)13-3)15-6-4-9(12-2)5-7-15/h8-9,12H,4-7H2,1-3H3,(H2,13,14,16,17)
InChIKeyNCSVTSQSHDZJKP-UHFFFAOYSA-N
MW242.32 g/mol
LogP-0.49
Rot. Bonds3

About 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide

2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide (PubChem CID 60820303) has the molecular formula C11H22N4O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide
PubChem CID60820303
Molecular FormulaC11H22N4O2
Molecular Weight242.32 g/mol
Exact Mass242.17
IUPAC Name2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)N1CCC(NC)CC1
InChIInChI=1S/C11H22N4O2/c1-8(10(16)14-11(17)13-3)15-6-4-9(12-2)5-7-15/h8-9,12H,4-7H2,1-3H3,(H2,13,14,16,17)
InChIKeyNCSVTSQSHDZJKP-UHFFFAOYSA-N
XLogP-0.49
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-0.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide?
The IUPAC name of 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide (CID 60820303) is 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide.
What is the SMILES notation for 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide?
The canonical SMILES for 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide is CNC(=O)NC(=O)C(C)N1CCC(NC)CC1.
What is the InChIKey of 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide?
The InChIKey is NCSVTSQSHDZJKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O2/c1-8(10(16)14-11(17)13-3)15-6-4-9(12-2)5-7-15/h8-9,12H,4-7H2,1-3H3,(H2,13,14,16,17).
What are the key properties of 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide?
2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide has a molecular weight of 242.32 g/mol, XLogP of -0.49, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide is sourced from PubChem (CID 60820303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).