2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine

C14H25NO — CID 102952252

IUPAC2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine
SMILESCC1OCCC1NC1CCC12CCCCC2
InChIInChI=1S/C14H25NO/c1-11-12(6-10-16-11)15-13-5-9-14(13)7-3-2-4-8-14/h11-13,15H,2-10H2,1H3
InChIKeyVXTGIGPKZVOXRH-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.87
Rot. Bonds2

About 2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine

2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine (PubChem CID 102952252) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine.

Molecular Properties

Compound Name2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine
PubChem CID102952252
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine
SMILESCC1OCCC1NC1CCC12CCCCC2
InChIInChI=1S/C14H25NO/c1-11-12(6-10-16-11)15-13-5-9-14(13)7-3-2-4-8-14/h11-13,15H,2-10H2,1H3
InChIKeyVXTGIGPKZVOXRH-UHFFFAOYSA-N
XLogP2.87
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine?
The IUPAC name of 2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine (CID 102952252) is 2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine.
What is the SMILES notation for 2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine?
The canonical SMILES for 2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine is CC1OCCC1NC1CCC12CCCCC2.
What is the InChIKey of 2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine?
The InChIKey is VXTGIGPKZVOXRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-11-12(6-10-16-11)15-13-5-9-14(13)7-3-2-4-8-14/h11-13,15H,2-10H2,1H3.
What are the key properties of 2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine?
2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine has a molecular weight of 223.36 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-spiro[3.5]nonan-3-yloxolan-3-amine is sourced from PubChem (CID 102952252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).