3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine

C13H26N2O — CID 63335338

IUPAC3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine
SMILESCC1CCCCC1N(C)C1(CN)CCOC1
InChIInChI=1S/C13H26N2O/c1-11-5-3-4-6-12(11)15(2)13(9-14)7-8-16-10-13/h11-12H,3-10,14H2,1-2H3
InChIKeyWJEOGLCMHDJLEG-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.61
Rot. Bonds3

About 3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine

3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine (PubChem CID 63335338) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine
PubChem CID63335338
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine
SMILESCC1CCCCC1N(C)C1(CN)CCOC1
InChIInChI=1S/C13H26N2O/c1-11-5-3-4-6-12(11)15(2)13(9-14)7-8-16-10-13/h11-12H,3-10,14H2,1-2H3
InChIKeyWJEOGLCMHDJLEG-UHFFFAOYSA-N
XLogP1.61
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxepan-4-amine
CID 65079445
1-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)-4-propan-2-ylcyclohexan-1-amine
CID 63467007
3-(aminomethyl)-N-(cyclopentylmethyl)-N-methyloxolan-3-amine
CID 63630516
1-(aminomethyl)-4-tert-butyl-N-methyl-N-(2-methylcyclohexyl)cyclohexan-1-amine
CID 63465218
N-[3-(aminomethyl)oxolan-3-yl]-N,1-dimethylpiperidin-4-amine
CID 63335656
N-[1-(aminomethyl)-3-propan-2-ylcyclobutyl]-N,2-dimethylcyclohexan-1-amine
CID 103562769
6-(aminomethyl)-N-cyclopropyl-N-methyl-1,4-dioxepan-6-amine
CID 126981781
N-[1-(aminomethyl)cyclobutyl]-N,4-dimethyloxolan-3-amine
CID 164650876
N-[1-(aminomethyl)cyclohexyl]-N,2-dimethyloxolan-3-amine
CID 82735395
3-(aminomethyl)-N-(1,1-dioxothiolan-3-yl)-N-methyloxolan-3-amine
CID 63335117
3-(aminomethyl)-N-cyclopropyl-N-propyloxolan-3-amine
CID 63335549
3-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)oxolan-3-amine
CID 63335231

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine?
The IUPAC name of 3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine (CID 63335338) is 3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine.
What is the SMILES notation for 3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine?
The canonical SMILES for 3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine is CC1CCCCC1N(C)C1(CN)CCOC1.
What is the InChIKey of 3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine?
The InChIKey is WJEOGLCMHDJLEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-11-5-3-4-6-12(11)15(2)13(9-14)7-8-16-10-13/h11-12H,3-10,14H2,1-2H3.
What are the key properties of 3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine?
3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine has a molecular weight of 226.36 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-methyl-N-(2-methylcyclohexyl)oxolan-3-amine is sourced from PubChem (CID 63335338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).