N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine

C11H19N3O — CID 102634501

IUPACN-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine
SMILESCNC1CCCCC1Oc1nccn1C
InChIInChI=1S/C11H19N3O/c1-12-9-5-3-4-6-10(9)15-11-13-7-8-14(11)2/h7-10,12H,3-6H2,1-2H3
InChIKeyRETDTCBYFAJXDH-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.33
Rot. Bonds3

About N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine

N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine (PubChem CID 102634501) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine
PubChem CID102634501
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine
SMILESCNC1CCCCC1Oc1nccn1C
InChIInChI=1S/C11H19N3O/c1-12-9-5-3-4-6-10(9)15-11-13-7-8-14(11)2/h7-10,12H,3-6H2,1-2H3
InChIKeyRETDTCBYFAJXDH-UHFFFAOYSA-N
XLogP1.33
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine?
The IUPAC name of N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine (CID 102634501) is N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine.
What is the SMILES notation for N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine?
The canonical SMILES for N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine is CNC1CCCCC1Oc1nccn1C.
What is the InChIKey of N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine?
The InChIKey is RETDTCBYFAJXDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-12-9-5-3-4-6-10(9)15-11-13-7-8-14(11)2/h7-10,12H,3-6H2,1-2H3.
What are the key properties of N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine?
N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine has a molecular weight of 209.29 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine is sourced from PubChem (CID 102634501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).