(2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine

C14H25NO — CID 79911431

IUPAC(2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine
SMILESCC1CC1C(N)C1CCOC2(CCCC2)C1
InChIInChI=1S/C14H25NO/c1-10-8-12(10)13(15)11-4-7-16-14(9-11)5-2-3-6-14/h10-13H,2-9,15H2,1H3
InChIKeyJDUNHEPKUUMKBW-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.71
Rot. Bonds2

About (2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine

(2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine (PubChem CID 79911431) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is (2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine.

Molecular Properties

Compound Name(2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine
PubChem CID79911431
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name(2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine
SMILESCC1CC1C(N)C1CCOC2(CCCC2)C1
InChIInChI=1S/C14H25NO/c1-10-8-12(10)13(15)11-4-7-16-14(9-11)5-2-3-6-14/h10-13H,2-9,15H2,1H3
InChIKeyJDUNHEPKUUMKBW-UHFFFAOYSA-N
XLogP2.71
TPSA35.25 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 ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine?
The IUPAC name of (2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine (CID 79911431) is (2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine.
What is the SMILES notation for (2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine?
The canonical SMILES for (2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine is CC1CC1C(N)C1CCOC2(CCCC2)C1.
What is the InChIKey of (2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine?
The InChIKey is JDUNHEPKUUMKBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-10-8-12(10)13(15)11-4-7-16-14(9-11)5-2-3-6-14/h10-13H,2-9,15H2,1H3.
What are the key properties of (2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine?
(2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine has a molecular weight of 223.36 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylcyclopropyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine is sourced from PubChem (CID 79911431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).