4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid

C14H24N2O3 — CID 18982152

IUPAC4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid
SMILESNC(CCC(=O)O)C(=O)N1CCC2(CCCC2)CC1
InChIInChI=1S/C14H24N2O3/c15-11(3-4-12(17)18)13(19)16-9-7-14(8-10-16)5-1-2-6-14/h11H,1-10,15H2,(H,17,18)
InChIKeyRYTXKLDNSFAORK-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.36
Rot. Bonds4

About 4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid

4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid (PubChem CID 18982152) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid.

Molecular Properties

Compound Name4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid
PubChem CID18982152
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid
SMILESNC(CCC(=O)O)C(=O)N1CCC2(CCCC2)CC1
InChIInChI=1S/C14H24N2O3/c15-11(3-4-12(17)18)13(19)16-9-7-14(8-10-16)5-1-2-6-14/h11H,1-10,15H2,(H,17,18)
InChIKeyRYTXKLDNSFAORK-UHFFFAOYSA-N
XLogP1.36
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid?
The IUPAC name of 4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid (CID 18982152) is 4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid.
What is the SMILES notation for 4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid?
The canonical SMILES for 4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid is NC(CCC(=O)O)C(=O)N1CCC2(CCCC2)CC1.
What is the InChIKey of 4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid?
The InChIKey is RYTXKLDNSFAORK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c15-11(3-4-12(17)18)13(19)16-9-7-14(8-10-16)5-1-2-6-14/h11H,1-10,15H2,(H,17,18).
What are the key properties of 4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid?
4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid has a molecular weight of 268.36 g/mol, XLogP of 1.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-(8-azaspiro[4.5]decan-8-yl)-5-oxopentanoic acid is sourced from PubChem (CID 18982152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).