5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine

C19H35NO — CID 102901368

IUPAC5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine
SMILESCC1CCC(C(C)(C)CC2CCC3(CCCC3)O2)C(N)C1
InChIInChI=1S/C19H35NO/c1-14-6-7-16(17(20)12-14)18(2,3)13-15-8-11-19(21-15)9-4-5-10-19/h14-17H,4-13,20H2,1-3H3
InChIKeyNNWNEKZRBNCLKM-UHFFFAOYSA-N
MW293.49 g/mol
LogP4.66
Rot. Bonds3

About 5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine

5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine (PubChem CID 102901368) has the molecular formula C19H35NO and a molecular weight of 293.49 g/mol. Its IUPAC name is 5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine.

Molecular Properties

Compound Name5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine
PubChem CID102901368
Molecular FormulaC19H35NO
Molecular Weight293.49 g/mol
Exact Mass293.27
IUPAC Name5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine
SMILESCC1CCC(C(C)(C)CC2CCC3(CCCC3)O2)C(N)C1
InChIInChI=1S/C19H35NO/c1-14-6-7-16(17(20)12-14)18(2,3)13-15-8-11-19(21-15)9-4-5-10-19/h14-17H,4-13,20H2,1-3H3
InChIKeyNNWNEKZRBNCLKM-UHFFFAOYSA-N
XLogP4.66
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.49
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine with MolForge

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Related Compounds

2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine
CID 64765709
2-methyl-2-(1-oxaspiro[4.4]nonan-2-ylmethyl)propane-1,3-diol
CID 102902443
2-[(2-chloro-5-methylcyclohexyl)methyl]-1-oxaspiro[4.5]decane
CID 102899914
2-(3-chloro-2,2-dimethylpropyl)-1-oxaspiro[4.5]decane
CID 102902077
5-methyl-2-[2-methyl-5-(oxolan-2-yl)pentan-2-yl]cyclohexan-1-amine
CID 65165198
2,2-dimethyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)propan-1-amine
CID 102896955
5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine
CID 64765358
[3-methyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)cyclohexyl]methanamine
CID 102901857
2-(4-bromo-2,2-dimethylpentyl)-1-oxaspiro[4.4]nonane
CID 102901466
2-(1-oxaspiro[4.4]nonan-2-ylmethyl)-4-propylcyclohexan-1-amine
CID 102899052
2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)propan-2-amine
CID 102896742
2-[2-(chloromethyl)-2-methylbut-3-enyl]-1-oxaspiro[4.5]decane
CID 102902372

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine?
The IUPAC name of 5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine (CID 102901368) is 5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine.
What is the SMILES notation for 5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine?
The canonical SMILES for 5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine is CC1CCC(C(C)(C)CC2CCC3(CCCC3)O2)C(N)C1.
What is the InChIKey of 5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine?
The InChIKey is NNWNEKZRBNCLKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35NO/c1-14-6-7-16(17(20)12-14)18(2,3)13-15-8-11-19(21-15)9-4-5-10-19/h14-17H,4-13,20H2,1-3H3.
What are the key properties of 5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine?
5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine has a molecular weight of 293.49 g/mol, XLogP of 4.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[2-methyl-1-(1-oxaspiro[4.4]nonan-2-yl)propan-2-yl]cyclohexan-1-amine is sourced from PubChem (CID 102901368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).