N,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine

C12H25NO — CID 58365089

IUPACN,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine
SMILESCN(C)C1CCC(OC(C)(C)C)CC1
InChIInChI=1S/C12H25NO/c1-12(2,3)14-11-8-6-10(7-9-11)13(4)5/h10-11H,6-9H2,1-5H3
InChIKeyRALMJYCXKPIWLM-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.67
Rot. Bonds2

About N,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine

N,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine (PubChem CID 58365089) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is N,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine
PubChem CID58365089
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC NameN,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine
SMILESCN(C)C1CCC(OC(C)(C)C)CC1
InChIInChI=1S/C12H25NO/c1-12(2,3)14-11-8-6-10(7-9-11)13(4)5/h10-11H,6-9H2,1-5H3
InChIKeyRALMJYCXKPIWLM-UHFFFAOYSA-N
XLogP2.67
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine?
The IUPAC name of N,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine (CID 58365089) is N,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine.
What is the SMILES notation for N,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine?
The canonical SMILES for N,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine is CN(C)C1CCC(OC(C)(C)C)CC1.
What is the InChIKey of N,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine?
The InChIKey is RALMJYCXKPIWLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-12(2,3)14-11-8-6-10(7-9-11)13(4)5/h10-11H,6-9H2,1-5H3.
What are the key properties of N,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine?
N,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine has a molecular weight of 199.34 g/mol, XLogP of 2.67, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine is sourced from PubChem (CID 58365089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).