1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine

C14H27NO — CID 65330300

IUPAC1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine
SMILESCNC(C1CCOC1)C1CC(C)CC(C)C1
InChIInChI=1S/C14H27NO/c1-10-6-11(2)8-13(7-10)14(15-3)12-4-5-16-9-12/h10-15H,4-9H2,1-3H3
InChIKeyGNMYJBHLZUPFJW-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.68
Rot. Bonds3

About 1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine

1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine (PubChem CID 65330300) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine.

Molecular Properties

Compound Name1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine
PubChem CID65330300
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine
SMILESCNC(C1CCOC1)C1CC(C)CC(C)C1
InChIInChI=1S/C14H27NO/c1-10-6-11(2)8-13(7-10)14(15-3)12-4-5-16-9-12/h10-15H,4-9H2,1-3H3
InChIKeyGNMYJBHLZUPFJW-UHFFFAOYSA-N
XLogP2.68
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(3-methylcyclopentyl)-1-(oxolan-3-yl)methanamine
CID 65414174
N-methyl-1-(oxan-4-yl)-1-(oxolan-3-yl)methanamine
CID 65330243
1-cyclooctyl-N-methyl-1-(oxolan-3-yl)methanamine
CID 80603950
1-(3-ethylcyclopentyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 65410427
1-(3,5-dimethylcyclohexyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 65423221
[(3-methylcyclopentyl)-(oxolan-3-yl)methyl]hydrazine
CID 105233097
1-(5,6-dimethyl-1,4-dithian-2-yl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 103345883
1-(3-ethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 65330302
N-methyl-1-(oxolan-3-yl)-1-(2,4,5-trimethyloxolan-3-yl)methanamine
CID 115856404
N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine
CID 65421926
1-cycloheptyl-N-methyl-1-(oxan-4-yl)methanamine
CID 65399325
N-[(2-methylcyclopropyl)-(oxolan-3-yl)methyl]ethanamine
CID 65419974

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine?
The IUPAC name of 1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine (CID 65330300) is 1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine.
What is the SMILES notation for 1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine?
The canonical SMILES for 1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine is CNC(C1CCOC1)C1CC(C)CC(C)C1.
What is the InChIKey of 1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine?
The InChIKey is GNMYJBHLZUPFJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-10-6-11(2)8-13(7-10)14(15-3)12-4-5-16-9-12/h10-15H,4-9H2,1-3H3.
What are the key properties of 1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine?
1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine has a molecular weight of 225.38 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine is sourced from PubChem (CID 65330300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).