N-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide

C13H25N3O2 — CID 55133656

IUPACN-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide
SMILESCC(C)N(CC(N)=O)C(=O)CCC1CCNCC1
InChIInChI=1S/C13H25N3O2/c1-10(2)16(9-12(14)17)13(18)4-3-11-5-7-15-8-6-11/h10-11,15H,3-9H2,1-2H3,(H2,14,17)
InChIKeyURZKCEBYGMITSW-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.49
Rot. Bonds6

About N-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide

N-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide (PubChem CID 55133656) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide
PubChem CID55133656
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC NameN-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide
SMILESCC(C)N(CC(N)=O)C(=O)CCC1CCNCC1
InChIInChI=1S/C13H25N3O2/c1-10(2)16(9-12(14)17)13(18)4-3-11-5-7-15-8-6-11/h10-11,15H,3-9H2,1-2H3,(H2,14,17)
InChIKeyURZKCEBYGMITSW-UHFFFAOYSA-N
XLogP0.49
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-propan-2-ylpropanamide
CID 55117201
N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-piperidin-4-ylpropanamide
CID 62211442
N-methyl-3-piperidin-4-yl-N-propan-2-ylpropanamide
CID 62211368
2-[butan-2-yl(3-piperidin-4-ylpropanoyl)amino]acetic acid
CID 62210937
2-[(2-piperidin-4-ylsulfanylacetyl)-propan-2-ylamino]acetamide
CID 114626630
N-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylbutanamide;hydrochloride
CID 119684345
N-methyl-N-(3-methylbutan-2-yl)-3-piperidin-4-ylpropanamide
CID 62210167
4-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpentanamide
CID 79720418
N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide
CID 62210682
2-[methyl(3-piperidin-4-ylpropanoyl)amino]acetic acid
CID 62212379
N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide
CID 54923747
3-[1-[(2-amino-2-oxoethyl)-propan-2-ylcarbamoyl]piperidin-4-yl]propanoic acid
CID 62210644

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide (CID 55133656) is N-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide is CC(C)N(CC(N)=O)C(=O)CCC1CCNCC1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide?
The InChIKey is URZKCEBYGMITSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-10(2)16(9-12(14)17)13(18)4-3-11-5-7-15-8-6-11/h10-11,15H,3-9H2,1-2H3,(H2,14,17).
What are the key properties of N-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide?
N-(2-amino-2-oxoethyl)-3-piperidin-4-yl-N-propan-2-ylpropanamide has a molecular weight of 255.36 g/mol, XLogP of 0.49, 6 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)-3-piperidin-4-yl-N-propan-2-ylpropanamide is sourced from PubChem (CID 55133656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).