1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine

C17H33NO2 — CID 116771534

IUPAC1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine
SMILESCNC(CCCC1CCCO1)C(OC)C1CCCCC1
InChIInChI=1S/C17H33NO2/c1-18-16(12-6-10-15-11-7-13-20-15)17(19-2)14-8-4-3-5-9-14/h14-18H,3-13H2,1-2H3
InChIKeyQGMBJNAIZUNHDY-UHFFFAOYSA-N
MW283.46 g/mol
LogP3.52
Rot. Bonds8

About 1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine

1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine (PubChem CID 116771534) has the molecular formula C17H33NO2 and a molecular weight of 283.46 g/mol. Its IUPAC name is 1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine
PubChem CID116771534
Molecular FormulaC17H33NO2
Molecular Weight283.46 g/mol
Exact Mass283.25
IUPAC Name1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine
SMILESCNC(CCCC1CCCO1)C(OC)C1CCCCC1
InChIInChI=1S/C17H33NO2/c1-18-16(12-6-10-15-11-7-13-20-15)17(19-2)14-8-4-3-5-9-14/h14-18H,3-13H2,1-2H3
InChIKeyQGMBJNAIZUNHDY-UHFFFAOYSA-N
XLogP3.52
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-cyclohexyl-1-methoxy-4-(oxolan-2-yl)butan-2-yl]hydrazine
CID 105278623
N,5-dimethyl-1-(oxolan-2-yl)heptan-4-amine
CID 65164663
1-cyclobutyl-N-methyl-4-(oxolan-2-yl)butan-1-amine
CID 65164623
1,1-diethoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine
CID 79496181
1-cyclohexyl-1-methoxy-4-(oxolan-2-yl)butan-2-amine
CID 116771262
N,5,6-trimethyl-1-(oxolan-2-yl)heptan-4-amine
CID 104993166
[1-cyclopropyl-1-ethoxy-5-(oxolan-2-yl)pentan-2-yl]hydrazine
CID 105273156
N-methyl-1-(3-methylcyclopentyl)-4-(oxolan-2-yl)butan-1-amine
CID 65413363
5-ethyl-N-methyl-1-(oxolan-2-yl)nonan-4-amine
CID 104993154
N-[(1R)-1-cyclohexylethyl]-3-(oxolan-2-yl)propan-1-amine
CID 81385044
N-methyl-4-(oxolan-2-yl)-1-(oxolan-3-yl)butan-1-amine
CID 65330358
N,4-dimethyl-1-(oxolan-2-yl)pentan-3-amine
CID 62549646

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine?
The IUPAC name of 1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine (CID 116771534) is 1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine.
What is the SMILES notation for 1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine?
The canonical SMILES for 1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine is CNC(CCCC1CCCO1)C(OC)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine?
The InChIKey is QGMBJNAIZUNHDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO2/c1-18-16(12-6-10-15-11-7-13-20-15)17(19-2)14-8-4-3-5-9-14/h14-18H,3-13H2,1-2H3.
What are the key properties of 1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine?
1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine has a molecular weight of 283.46 g/mol, XLogP of 3.52, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-methoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine is sourced from PubChem (CID 116771534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).