6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine

C17H31NO — CID 105016821

IUPAC6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine
SMILESCC1(C)C(C(N)C2CCOC3(CCCC3)C2)C1(C)C
InChIInChI=1S/C17H31NO/c1-15(2)14(16(15,3)4)13(18)12-7-10-19-17(11-12)8-5-6-9-17/h12-14H,5-11,18H2,1-4H3
InChIKeyQRFIFPBHFISKPC-UHFFFAOYSA-N
MW265.44 g/mol
LogP3.74
Rot. Bonds2

About 6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine

6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine (PubChem CID 105016821) has the molecular formula C17H31NO and a molecular weight of 265.44 g/mol. Its IUPAC name is 6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine.

Molecular Properties

Compound Name6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine
PubChem CID105016821
Molecular FormulaC17H31NO
Molecular Weight265.44 g/mol
Exact Mass265.24
IUPAC Name6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine
SMILESCC1(C)C(C(N)C2CCOC3(CCCC3)C2)C1(C)C
InChIInChI=1S/C17H31NO/c1-15(2)14(16(15,3)4)13(18)12-7-10-19-17(11-12)8-5-6-9-17/h12-14H,5-11,18H2,1-4H3
InChIKeyQRFIFPBHFISKPC-UHFFFAOYSA-N
XLogP3.74
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine with MolForge

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Related Compounds

(4,4-dimethylcyclohexyl)-(1-oxaspiro[5.5]undecan-4-yl)methanamine
CID 79910537
cyclopentyl(6-oxaspiro[4.5]decan-9-yl)methanamine
CID 79914728
(3-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine
CID 79914646
N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 105016820
oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine
CID 79911423
cyclohexyl(1,9-dioxaspiro[5.5]undecan-4-yl)methanamine
CID 79914524
1-(1-oxaspiro[5.5]undecan-4-yl)butan-1-amine
CID 79914693
(4,4-dimethylcyclohexyl)-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)methanamine
CID 79910538
(1-methoxycyclopentyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine
CID 104610599
5-oxaspiro[3.5]nonan-8-yl-(4-propylcyclohexyl)methanamine
CID 79912209
(1,4-dimethylpiperazin-2-yl)-(1-oxaspiro[5.5]undecan-4-yl)methanamine
CID 79907565
1,9-dioxaspiro[5.5]undecan-4-yl-(4-methylcyclohexyl)methanamine
CID 79914564

Frequently Asked Questions

What is the IUPAC name of 6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The IUPAC name of 6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine (CID 105016821) is 6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine.
What is the SMILES notation for 6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The canonical SMILES for 6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine is CC1(C)C(C(N)C2CCOC3(CCCC3)C2)C1(C)C.
What is the InChIKey of 6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The InChIKey is QRFIFPBHFISKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31NO/c1-15(2)14(16(15,3)4)13(18)12-7-10-19-17(11-12)8-5-6-9-17/h12-14H,5-11,18H2,1-4H3.
What are the key properties of 6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine?
6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine has a molecular weight of 265.44 g/mol, XLogP of 3.74, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine is sourced from PubChem (CID 105016821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).