2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide

C11H22N4O2 — CID 120776742

IUPAC2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide
SMILESCC(C(=O)NC(N)=O)N1CCC(N)C(C)(C)C1
InChIInChI=1S/C11H22N4O2/c1-7(9(16)14-10(13)17)15-5-4-8(12)11(2,3)6-15/h7-8H,4-6,12H2,1-3H3,(H3,13,14,16,17)
InChIKeyWLZRAHQMCDKYEM-UHFFFAOYSA-N
MW242.32 g/mol
LogP-0.37
Rot. Bonds2

About 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide

2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide (PubChem CID 120776742) has the molecular formula C11H22N4O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide.

Molecular Properties

Compound Name2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide
PubChem CID120776742
Molecular FormulaC11H22N4O2
Molecular Weight242.32 g/mol
Exact Mass242.17
IUPAC Name2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide
SMILESCC(C(=O)NC(N)=O)N1CCC(N)C(C)(C)C1
InChIInChI=1S/C11H22N4O2/c1-7(9(16)14-10(13)17)15-5-4-8(12)11(2,3)6-15/h7-8H,4-6,12H2,1-3H3,(H3,13,14,16,17)
InChIKeyWLZRAHQMCDKYEM-UHFFFAOYSA-N
XLogP-0.37
TPSA101.45 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 ≤ 5-0.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-cyclohexylpropanamide
CID 120775751
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(prop-2-enylcarbamoyl)propanamide;hydrochloride
CID 120775148
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(2,4,6-trimethylphenyl)propanamide
CID 120774348
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(4-methoxyphenyl)propanamide
CID 120776022
N-carbamoyl-2-(3-hydroxy-3-methylpiperidin-1-yl)propanamide
CID 115874185
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)propanamide;hydrochloride
CID 120774297
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(2-bromophenyl)propanamide;hydrochloride
CID 120776287
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(2,3-dichlorophenyl)propanamide
CID 120775712
2-(4-amino-3,3-dimethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)propan-1-one;hydrochloride
CID 120776079
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N,N-diethylpropanamide;hydrochloride
CID 120774556
N-carbamoyl-2-[4-[1-(methylamino)ethyl]piperidin-1-yl]propanamide
CID 55256660
2-[3-(1-aminoethyl)pyrrolidin-1-yl]-N-carbamoylpropanamide
CID 112630191

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide?
The IUPAC name of 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide (CID 120776742) is 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide.
What is the SMILES notation for 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide?
The canonical SMILES for 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide is CC(C(=O)NC(N)=O)N1CCC(N)C(C)(C)C1.
What is the InChIKey of 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide?
The InChIKey is WLZRAHQMCDKYEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O2/c1-7(9(16)14-10(13)17)15-5-4-8(12)11(2,3)6-15/h7-8H,4-6,12H2,1-3H3,(H3,13,14,16,17).
What are the key properties of 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide?
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide has a molecular weight of 242.32 g/mol, XLogP of -0.37, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-carbamoylpropanamide is sourced from PubChem (CID 120776742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).