2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide

C11H21N3O — CID 164653521

IUPAC2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide
SMILESCC(C(N)C(N)=O)N1CCCC2(CC2)C1
InChIInChI=1S/C11H21N3O/c1-8(9(12)10(13)15)14-6-2-3-11(7-14)4-5-11/h8-9H,2-7,12H2,1H3,(H2,13,15)
InChIKeyDCPNUGBETJCDPO-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.06
Rot. Bonds3

About 2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide

2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide (PubChem CID 164653521) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide.

Molecular Properties

Compound Name2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide
PubChem CID164653521
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide
SMILESCC(C(N)C(N)=O)N1CCCC2(CC2)C1
InChIInChI=1S/C11H21N3O/c1-8(9(12)10(13)15)14-6-2-3-11(7-14)4-5-11/h8-9H,2-7,12H2,1H3,(H2,13,15)
InChIKeyDCPNUGBETJCDPO-UHFFFAOYSA-N
XLogP0.06
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-azaspiro[2.4]heptan-5-yl)ethanamine
CID 178155923
2,9-di(propan-2-yl)-2,9-diazaspiro[5.5]undecane;ethane
CID 172605205
methyl 2-(2-azaspiro[4.4]nonan-2-yl)propanoate
CID 130161407
(2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride
CID 119338501
2-amino-1-(6-azaspiro[3.4]octan-6-yl)-3-methylbutan-1-one
CID 119326633
1-amino-3-(5-azaspiro[2.4]heptan-5-yl)butan-2-ol
CID 164657577
3-(2-azaspiro[3.4]octan-2-yl)butan-2-amine
CID 130963997
(2R)-2-amino-1-(2-azaspiro[4.4]nonan-2-yl)propan-1-one
CID 130163238
(2S)-2-pyrrolidin-1-ylpropanamide
CID 39248173
6-but-3-en-2-yl-6-azaspiro[3.5]nonane
CID 130905971
2-amino-1-(2-azaspiro[5.5]undecan-2-yl)-3-methylpentan-1-one;hydrochloride
CID 119784774
2,2,2-trifluoro-1-(8-propan-2-yl-2,8-diazaspiro[3.5]nonan-2-yl)ethanone
CID 171415786

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide?
The IUPAC name of 2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide (CID 164653521) is 2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide.
What is the SMILES notation for 2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide?
The canonical SMILES for 2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide is CC(C(N)C(N)=O)N1CCCC2(CC2)C1.
What is the InChIKey of 2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide?
The InChIKey is DCPNUGBETJCDPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-8(9(12)10(13)15)14-6-2-3-11(7-14)4-5-11/h8-9H,2-7,12H2,1H3,(H2,13,15).
What are the key properties of 2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide?
2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide has a molecular weight of 211.31 g/mol, XLogP of 0.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(5-azaspiro[2.5]octan-5-yl)butanamide is sourced from PubChem (CID 164653521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).