4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide

C14H27N3O — CID 66427333

IUPAC4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide
SMILESNCC(CC(N)=O)N1CCC2(CCCCC2)CC1
InChIInChI=1S/C14H27N3O/c15-11-12(10-13(16)18)17-8-6-14(7-9-17)4-2-1-3-5-14/h12H,1-11,15H2,(H2,16,18)
InChIKeySREZOTRPHLMQHT-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.24
Rot. Bonds4

About 4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide

4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide (PubChem CID 66427333) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide.

Molecular Properties

Compound Name4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide
PubChem CID66427333
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide
SMILESNCC(CC(N)=O)N1CCC2(CCCCC2)CC1
InChIInChI=1S/C14H27N3O/c15-11-12(10-13(16)18)17-8-6-14(7-9-17)4-2-1-3-5-14/h12H,1-11,15H2,(H2,16,18)
InChIKeySREZOTRPHLMQHT-UHFFFAOYSA-N
XLogP1.24
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-3-(3-azaspiro[5.5]undecan-3-yl)-N-propylbutanamide
CID 66428881
4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide
CID 66427753
3-amino-2-(8-azaspiro[4.5]decan-8-yl)propanoic acid
CID 64695224
2-(3-azaspiro[5.5]undecan-3-yl)butanamide
CID 62921660
4-amino-3-(4-propan-2-ylazepan-1-yl)butanamide
CID 66426900
4-amino-3-(4-tert-butylpiperidin-1-yl)butanamide
CID 66426477
2-(8-azaspiro[4.5]decan-8-yl)butanamide
CID 63159383
4-amino-1-(3-azaspiro[5.5]undecan-3-yl)-3-methylbutan-1-one
CID 81079240
methyl 3-(3-azaspiro[5.5]undecan-3-yl)-2-methylbutanoate
CID 79414044
3-(8-azaspiro[4.5]decan-8-yl)butanoic acid
CID 63158284
2-(8-azaspiro[4.5]decan-8-yl)-3-methylbutan-1-amine
CID 63157149
4-amino-3-(7,7-dimethyl-1,4-thiazepan-4-yl)-N,N-diethylbutanamide
CID 107454311

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide?
The IUPAC name of 4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide (CID 66427333) is 4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide.
What is the SMILES notation for 4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide?
The canonical SMILES for 4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide is NCC(CC(N)=O)N1CCC2(CCCCC2)CC1.
What is the InChIKey of 4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide?
The InChIKey is SREZOTRPHLMQHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c15-11-12(10-13(16)18)17-8-6-14(7-9-17)4-2-1-3-5-14/h12H,1-11,15H2,(H2,16,18).
What are the key properties of 4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide?
4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide has a molecular weight of 253.39 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide is sourced from PubChem (CID 66427333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).