2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine

C11H23NO — CID 64747965

IUPAC2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine
SMILESCC1CCC(OCC(C)(C)N)CC1
InChIInChI=1S/C11H23NO/c1-9-4-6-10(7-5-9)13-8-11(2,3)12/h9-10H,4-8,12H2,1-3H3
InChIKeyQQFDRWSIFTZECY-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.32
Rot. Bonds3

About 2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine

2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine (PubChem CID 64747965) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine.

Molecular Properties

Compound Name2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine
PubChem CID64747965
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine
SMILESCC1CCC(OCC(C)(C)N)CC1
InChIInChI=1S/C11H23NO/c1-9-4-6-10(7-5-9)13-8-11(2,3)12/h9-10H,4-8,12H2,1-3H3
InChIKeyQQFDRWSIFTZECY-UHFFFAOYSA-N
XLogP2.32
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine?
The IUPAC name of 2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine (CID 64747965) is 2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine.
What is the SMILES notation for 2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine?
The canonical SMILES for 2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine is CC1CCC(OCC(C)(C)N)CC1.
What is the InChIKey of 2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine?
The InChIKey is QQFDRWSIFTZECY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-9-4-6-10(7-5-9)13-8-11(2,3)12/h9-10H,4-8,12H2,1-3H3.
What are the key properties of 2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine?
2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine has a molecular weight of 185.31 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(4-methylcyclohexyl)oxypropan-2-amine is sourced from PubChem (CID 64747965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).