N-methyl-3-(2-methylpropoxy)cyclohexan-1-amine

C11H23NO — CID 79618009

IUPACN-methyl-3-(2-methylpropoxy)cyclohexan-1-amine
SMILESCNC1CCCC(OCC(C)C)C1
InChIInChI=1S/C11H23NO/c1-9(2)8-13-11-6-4-5-10(7-11)12-3/h9-12H,4-8H2,1-3H3
InChIKeyDIMISIFHLATVLO-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.19
Rot. Bonds4

About N-methyl-3-(2-methylpropoxy)cyclohexan-1-amine

N-methyl-3-(2-methylpropoxy)cyclohexan-1-amine (PubChem CID 79618009) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N-methyl-3-(2-methylpropoxy)cyclohexan-1-amine.

Molecular Properties

Compound NameN-methyl-3-(2-methylpropoxy)cyclohexan-1-amine
PubChem CID79618009
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN-methyl-3-(2-methylpropoxy)cyclohexan-1-amine
SMILESCNC1CCCC(OCC(C)C)C1
InChIInChI=1S/C11H23NO/c1-9(2)8-13-11-6-4-5-10(7-11)12-3/h9-12H,4-8H2,1-3H3
InChIKeyDIMISIFHLATVLO-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-bis(2-methylpropoxy)cyclohexane
CID 142724775
N-methyl-3-(2-propan-2-yloxyethoxy)cyclohexan-1-amine
CID 79618342
N-methyl-3-propoxycyclohexan-1-amine
CID 79618240
3-(1-methoxypropan-2-yloxy)-N-methylcyclohexan-1-amine
CID 79618809
N-(2-methylpropoxy)cyclobutanamine
CID 82712780
3-ethoxy-N-methylcyclopentan-1-amine
CID 79642997
3-cyclobutyloxy-N-methylcyclobutan-1-amine
CID 66350250
3-(2-methylpropoxy)cyclopentan-1-ol
CID 18953130
3-ethoxy-N-ethylcyclohexan-1-amine
CID 79619303
N-(2-methylpropoxy)cyclopentanamine
CID 82709938
3-methyl-N-(2-methylpropoxy)cyclohexan-1-amine
CID 82710052
N-methyl-3-pentan-2-ylcyclohexan-1-amine
CID 107888158

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(2-methylpropoxy)cyclohexan-1-amine?
The IUPAC name of N-methyl-3-(2-methylpropoxy)cyclohexan-1-amine (CID 79618009) is N-methyl-3-(2-methylpropoxy)cyclohexan-1-amine.
What is the SMILES notation for N-methyl-3-(2-methylpropoxy)cyclohexan-1-amine?
The canonical SMILES for N-methyl-3-(2-methylpropoxy)cyclohexan-1-amine is CNC1CCCC(OCC(C)C)C1.
What is the InChIKey of N-methyl-3-(2-methylpropoxy)cyclohexan-1-amine?
The InChIKey is DIMISIFHLATVLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-9(2)8-13-11-6-4-5-10(7-11)12-3/h9-12H,4-8H2,1-3H3.
What are the key properties of N-methyl-3-(2-methylpropoxy)cyclohexan-1-amine?
N-methyl-3-(2-methylpropoxy)cyclohexan-1-amine has a molecular weight of 185.31 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(2-methylpropoxy)cyclohexan-1-amine is sourced from PubChem (CID 79618009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).