2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine

C18H35NO — CID 79918089

IUPAC2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine
SMILESCC1CCC(C(C)C)C(NC2CC(C)(C)OC2(C)C)C1
InChIInChI=1S/C18H35NO/c1-12(2)14-9-8-13(3)10-15(14)19-16-11-17(4,5)20-18(16,6)7/h12-16,19H,8-11H2,1-7H3
InChIKeyHQZOXICYNYFCCJ-UHFFFAOYSA-N
MW281.48 g/mol
LogP4.38
Rot. Bonds3

About 2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine

2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine (PubChem CID 79918089) has the molecular formula C18H35NO and a molecular weight of 281.48 g/mol. Its IUPAC name is 2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine.

Molecular Properties

Compound Name2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine
PubChem CID79918089
Molecular FormulaC18H35NO
Molecular Weight281.48 g/mol
Exact Mass281.27
IUPAC Name2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine
SMILESCC1CCC(C(C)C)C(NC2CC(C)(C)OC2(C)C)C1
InChIInChI=1S/C18H35NO/c1-12(2)14-9-8-13(3)10-15(14)19-16-11-17(4,5)20-18(16,6)7/h12-16,19H,8-11H2,1-7H3
InChIKeyHQZOXICYNYFCCJ-UHFFFAOYSA-N
XLogP4.38
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.48
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine with MolForge

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Related Compounds

5-methyl-2-propan-2-yl-N-(3-propan-2-ylcyclobutyl)cyclohexan-1-amine
CID 103561293
5-methyl-N-(3-methylcyclohexyl)-2-propan-2-ylcyclohexan-1-amine
CID 43317464
N-(5-methyl-2-propan-2-ylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 43710247
N-[(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]formamide
CID 59847881
N-(5-methyl-2-propan-2-ylcyclohexyl)-1,1-dioxothian-4-amine
CID 43614944
N-(5-methyl-2-propan-2-ylcyclohexyl)azepan-4-amine
CID 103981217
1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine
CID 115720105
4-[(5-methyl-2-propan-2-ylcyclohexyl)amino]cyclohexane-1-carboxamide
CID 43748782
(2S)-4-methyl-1,2-di(propan-2-yl)cyclohexane
CID 169042978
cis-(2R,5R)-5-methyl-2-propan-2-yl-N-prop-2-ynylcyclohexan-1-amine
CID 130962040
(2R)-1-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propan-2-ol
CID 103906936
dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane
CID 177420575

Frequently Asked Questions

What is the IUPAC name of 2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine?
The IUPAC name of 2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine (CID 79918089) is 2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine.
What is the SMILES notation for 2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine?
The canonical SMILES for 2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine is CC1CCC(C(C)C)C(NC2CC(C)(C)OC2(C)C)C1.
What is the InChIKey of 2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine?
The InChIKey is HQZOXICYNYFCCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO/c1-12(2)14-9-8-13(3)10-15(14)19-16-11-17(4,5)20-18(16,6)7/h12-16,19H,8-11H2,1-7H3.
What are the key properties of 2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine?
2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine has a molecular weight of 281.48 g/mol, XLogP of 4.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,5-tetramethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)oxolan-3-amine is sourced from PubChem (CID 79918089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).