N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine

C14H23N3O2 — CID 97085806

IUPACN-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine
SMILESCC(C)c1noc(N[C@@H]2CCOC3(CCCC3)C2)n1
InChIInChI=1S/C14H23N3O2/c1-10(2)12-16-13(19-17-12)15-11-5-8-18-14(9-11)6-3-4-7-14/h10-11H,3-9H2,1-2H3,(H,15,16,17)/t11-/m1/s1
InChIKeyXJSTXPOKVAROIP-LLVKDONJSA-N
MW265.36 g/mol
LogP3.10
Rot. Bonds3

About N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine

N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine (PubChem CID 97085806) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine.

Molecular Properties

Compound NameN-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine
PubChem CID97085806
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine
SMILESCC(C)c1noc(N[C@@H]2CCOC3(CCCC3)C2)n1
InChIInChI=1S/C14H23N3O2/c1-10(2)12-16-13(19-17-12)15-11-5-8-18-14(9-11)6-3-4-7-14/h10-11H,3-9H2,1-2H3,(H,15,16,17)/t11-/m1/s1
InChIKeyXJSTXPOKVAROIP-LLVKDONJSA-N
XLogP3.10
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine with MolForge

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Related Compounds

N-(2-propan-2-ylphenyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79897852
1-[4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]cyclohexyl]pyrrolidine-2,5-dione
CID 133417574
4-methyl-N-[(9R)-6-oxaspiro[4.5]decan-9-yl]pyrimidin-2-amine
CID 97234618
6-methylsulfanyl-N-(6-oxaspiro[4.5]decan-9-yl)pyridazin-3-amine
CID 133377821
N-(4-methylphenyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79898330
N-(2-methylsulfanylphenyl)-6-oxaspiro[4.5]decan-9-amine
CID 107644684
N-(2-methylpropyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79898518
N-(2,2-diethyloxan-4-yl)-3-methyl-1,2,4-oxadiazol-5-amine
CID 106659872
4-N,4-N-dimethyl-1-N-(6-oxaspiro[4.5]decan-9-yl)benzene-1,4-diamine
CID 79895626
N-(3-methyl-2-propan-2-ylbutyl)-1-oxaspiro[5.5]undecan-4-amine
CID 102905388
N-(1-methylcyclopentyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79895290
N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79895072

Frequently Asked Questions

What is the IUPAC name of N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine?
The IUPAC name of N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine (CID 97085806) is N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine.
What is the SMILES notation for N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine?
The canonical SMILES for N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine is CC(C)c1noc(N[C@@H]2CCOC3(CCCC3)C2)n1.
What is the InChIKey of N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine?
The InChIKey is XJSTXPOKVAROIP-LLVKDONJSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-10(2)12-16-13(19-17-12)15-11-5-8-18-14(9-11)6-3-4-7-14/h10-11H,3-9H2,1-2H3,(H,15,16,17)/t11-/m1/s1.
What are the key properties of N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine?
N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine has a molecular weight of 265.36 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(9R)-6-oxaspiro[4.5]decan-9-yl]-3-propan-2-yl-1,2,4-oxadiazol-5-amine is sourced from PubChem (CID 97085806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).