2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine

C12H25NO — CID 62443960

IUPAC2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine
SMILESCCC1CCCCC1OC(C)CNC
InChIInChI=1S/C12H25NO/c1-4-11-7-5-6-8-12(11)14-10(2)9-13-3/h10-13H,4-9H2,1-3H3
InChIKeyNXRJPWRXUOJJRM-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.58
Rot. Bonds5

About 2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine

2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine (PubChem CID 62443960) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine.

Molecular Properties

Compound Name2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine
PubChem CID62443960
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine
SMILESCCC1CCCCC1OC(C)CNC
InChIInChI=1S/C12H25NO/c1-4-11-7-5-6-8-12(11)14-10(2)9-13-3/h10-13H,4-9H2,1-3H3
InChIKeyNXRJPWRXUOJJRM-UHFFFAOYSA-N
XLogP2.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine
CID 62444152
N-[2-(2-ethylcyclohexyl)oxypropyl]-2-methylpropan-2-amine
CID 55072973
3-(2-ethylcyclohexyl)oxybutan-1-amine
CID 114995089
(2-ethylcyclohexyl) 2-aminopropanoate
CID 61277036
1-ethyl-2-hydroperoxycyclohexane
CID 175085860
2-(2-methylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine
CID 62444144
ethyl 2-(2-ethylcyclohexyl)oxy-2-fluoroacetate
CID 79356654
2-(cycloheptylmethoxy)-N-methylpropan-1-amine
CID 165349469
N-methyl-2-(oxan-4-yloxy)propan-1-amine
CID 62440891
1-(2-ethylcyclohexyl)oxy-3-(methoxyamino)propan-2-ol
CID 60702585
1-(cyclohexylmethylamino)-3-(2-ethylcyclohexyl)oxypropan-2-ol
CID 60633455
(2-ethylcyclohexyl) 2-amino-3-methylbutanoate
CID 61277440

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine?
The IUPAC name of 2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine (CID 62443960) is 2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine.
What is the SMILES notation for 2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine?
The canonical SMILES for 2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine is CCC1CCCCC1OC(C)CNC.
What is the InChIKey of 2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine?
The InChIKey is NXRJPWRXUOJJRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-4-11-7-5-6-8-12(11)14-10(2)9-13-3/h10-13H,4-9H2,1-3H3.
What are the key properties of 2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine?
2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine has a molecular weight of 199.34 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine is sourced from PubChem (CID 62443960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).