N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide

C13H23N3O2 — CID 124516868

IUPACN-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide
SMILESCC(=O)N[C@@H]1CCCN(C(=O)CC2(N)CCC2)C1
InChIInChI=1S/C13H23N3O2/c1-10(17)15-11-4-2-7-16(9-11)12(18)8-13(14)5-3-6-13/h11H,2-9,14H2,1H3,(H,15,17)/t11-/m1/s1
InChIKeyDNMJGBFGGINXEZ-LLVKDONJSA-N
MW253.35 g/mol
LogP0.38
Rot. Bonds3

About N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide

N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide (PubChem CID 124516868) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide
PubChem CID124516868
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC NameN-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide
SMILESCC(=O)N[C@@H]1CCCN(C(=O)CC2(N)CCC2)C1
InChIInChI=1S/C13H23N3O2/c1-10(17)15-11-4-2-7-16(9-11)12(18)8-13(14)5-3-6-13/h11H,2-9,14H2,1H3,(H,15,17)/t11-/m1/s1
InChIKeyDNMJGBFGGINXEZ-LLVKDONJSA-N
XLogP0.38
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]methanesulfonamide
CID 79854784
N-[1-[2-(methylamino)acetyl]piperidin-3-yl]acetamide
CID 60947690
N-[1-(3-chloropropanoyl)piperidin-3-yl]acetamide
CID 60948683
N-[1-(1-aminocyclohexanecarbonyl)piperidin-3-yl]acetamide;hydrochloride
CID 119288778
2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone
CID 64683579
N-[1-[2-(4-aminopiperidin-1-yl)acetyl]piperidin-3-yl]acetamide;hydrochloride
CID 119908203
N-(1-acetylpiperidin-4-yl)-2-(1-aminocyclobutyl)acetamide
CID 79854676
3-[1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]butanoic acid
CID 81046858
2-(1-aminocyclobutyl)-1-[(3S)-3-hydroxypyrrolidin-1-yl]ethanone
CID 107217433
N-[1-[2-(3-methylbutan-2-ylsulfanyl)acetyl]piperidin-3-yl]acetamide
CID 71926391
N-[1-[2-[(1-hydroxycycloheptyl)methyl-methylamino]acetyl]piperidin-3-yl]acetamide
CID 154741836
N-[(3S)-1-[(2S)-2-aminopropanoyl]piperidin-3-yl]acetamide
CID 66567589

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide?
The IUPAC name of N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide (CID 124516868) is N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide.
What is the SMILES notation for N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide?
The canonical SMILES for N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide is CC(=O)N[C@@H]1CCCN(C(=O)CC2(N)CCC2)C1.
What is the InChIKey of N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide?
The InChIKey is DNMJGBFGGINXEZ-LLVKDONJSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-10(17)15-11-4-2-7-16(9-11)12(18)8-13(14)5-3-6-13/h11H,2-9,14H2,1H3,(H,15,17)/t11-/m1/s1.
What are the key properties of N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide?
N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide has a molecular weight of 253.35 g/mol, XLogP of 0.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide is sourced from PubChem (CID 124516868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).