N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide

C12H23N3O2 — CID 81044730

IUPACN-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide
SMILESCC(CC(=O)N(C)CC(N)=O)C1CCCNC1
InChIInChI=1S/C12H23N3O2/c1-9(10-4-3-5-14-7-10)6-12(17)15(2)8-11(13)16/h9-10,14H,3-8H2,1-2H3,(H2,13,16)
InChIKeyNALZJGDECFVICC-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.04
Rot. Bonds5

About N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide

N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide (PubChem CID 81044730) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide
PubChem CID81044730
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide
SMILESCC(CC(=O)N(C)CC(N)=O)C1CCCNC1
InChIInChI=1S/C12H23N3O2/c1-9(10-4-3-5-14-7-10)6-12(17)15(2)8-11(13)16/h9-10,14H,3-8H2,1-2H3,(H2,13,16)
InChIKeyNALZJGDECFVICC-UHFFFAOYSA-N
XLogP-0.04
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(2-methylpropyl)-3-piperidin-3-ylbutanamide
CID 81043828
N-methyl-3-piperidin-3-yl-N-propylbutanamide
CID 81043827
N-(2,2-difluoroethyl)-N-methyl-3-piperidin-3-ylbutanamide
CID 115738604
N-methyl-N-[2-(methylamino)ethyl]-3-piperidin-3-ylbutanamide
CID 81043953
N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride
CID 119672315
N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]-3-piperidin-3-ylbutanamide;hydrochloride
CID 119818677
N-[(4-fluorophenyl)methyl]-N-methyl-3-piperidin-3-ylbutanamide
CID 81049753
3-piperidin-3-yl-N,N-dipropylbutanamide
CID 81043811
2-[cyclopentyl(3-piperidin-3-ylbutanoyl)amino]acetic acid
CID 81048851
3-piperidin-3-ylbutanoic acid
CID 71691534
(3S)-3-[(3S)-piperidin-3-yl]butanoic acid
CID 95732451
N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-3-piperidin-3-ylbutanamide;hydrochloride
CID 119727174

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide (CID 81044730) is N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide is CC(CC(=O)N(C)CC(N)=O)C1CCCNC1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide?
The InChIKey is NALZJGDECFVICC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-9(10-4-3-5-14-7-10)6-12(17)15(2)8-11(13)16/h9-10,14H,3-8H2,1-2H3,(H2,13,16).
What are the key properties of N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide?
N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide has a molecular weight of 241.33 g/mol, XLogP of -0.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide is sourced from PubChem (CID 81044730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).