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

C11H23ClN4O2 — CID 119923499

IUPAC2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride
SMILESCNC(=O)NC(=O)C(C)N1CCC(NC)CC1.Cl
InChIInChI=1S/C11H22N4O2.ClH/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);1H
InChIKeyALFRBKZJPOYBQC-UHFFFAOYSA-N
MW278.78 g/mol
LogP-0.06
Rot. Bonds3

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

2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride (PubChem CID 119923499) has the molecular formula C11H23ClN4O2 and a molecular weight of 278.78 g/mol. Its IUPAC name is 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride.

Molecular Properties

Compound Name2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride
PubChem CID119923499
Molecular FormulaC11H23ClN4O2
Molecular Weight278.78 g/mol
Exact Mass278.15
IUPAC Name2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride
SMILESCNC(=O)NC(=O)C(C)N1CCC(NC)CC1.Cl
InChIInChI=1S/C11H22N4O2.ClH/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);1H
InChIKeyALFRBKZJPOYBQC-UHFFFAOYSA-N
XLogP-0.06
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.78
LogP ≤ 5-0.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide
CID 60820303
N-cyclopropyl-2-[4-(methylamino)piperidin-1-yl]propanamide
CID 60820306
3-[1-[1-(methylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]propanoic acid
CID 62216173
2-[3-(1-aminoethyl)pyrrolidin-1-yl]-N-(methylcarbamoyl)propanamide
CID 112630269
(2S)-2-[4-(benzenesulfonamido)piperidin-1-yl]-N-(methylcarbamoyl)propanamide
CID 40811536
2-(4-amino-3-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide
CID 79867465
2-[4-(methylamino)piperidin-1-yl]-N-(2-methylpropyl)propanamide
CID 60820142
2-[4-(1-cyanoethyl)piperazin-1-yl]-N-(methylcarbamoyl)propanamide
CID 63341284
1-[1-(methylcarbamoylamino)-1-oxopropan-2-yl]-N-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
CID 42955074
2-(3-aminoazetidin-1-yl)-N-(methylcarbamoyl)propanamide
CID 63761122
2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide
CID 60820308
2-(3,5-dimethylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide
CID 51170713

Frequently Asked Questions

What is the IUPAC name of 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride?
The IUPAC name of 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride (CID 119923499) is 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride.
What is the SMILES notation for 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride?
The canonical SMILES for 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride is CNC(=O)NC(=O)C(C)N1CCC(NC)CC1.Cl.
What is the InChIKey of 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride?
The InChIKey is ALFRBKZJPOYBQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O2.ClH/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);1H.
What are the key properties of 2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride?
2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide;hydrochloride has a molecular weight of 278.78 g/mol, XLogP of -0.06, 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;hydrochloride is sourced from PubChem (CID 119923499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).