(6-cyclohexyloxy-3-pyridinyl)methanamine

C12H18N2O — CID 16781318

IUPAC(6-cyclohexyloxy-3-pyridinyl)methanamine
SMILESNCc1ccc(OC2CCCCC2)nc1
InChIInChI=1S/C12H18N2O/c13-8-10-6-7-12(14-9-10)15-11-4-2-1-3-5-11/h6-7,9,11H,1-5,8,13H2
InChIKeyKBEXCOQBYDIUNO-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.25
Rot. Bonds3

About (6-cyclohexyloxy-3-pyridinyl)methanamine

(6-cyclohexyloxy-3-pyridinyl)methanamine (PubChem CID 16781318) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is (6-cyclohexyloxy-3-pyridinyl)methanamine.

Molecular Properties

Compound Name(6-cyclohexyloxy-3-pyridinyl)methanamine
PubChem CID16781318
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name(6-cyclohexyloxy-3-pyridinyl)methanamine
SMILESNCc1ccc(OC2CCCCC2)nc1
InChIInChI=1S/C12H18N2O/c13-8-10-6-7-12(14-9-10)15-11-4-2-1-3-5-11/h6-7,9,11H,1-5,8,13H2
InChIKeyKBEXCOQBYDIUNO-UHFFFAOYSA-N
XLogP2.25
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (6-cyclohexyloxy-3-pyridinyl)methanamine?
The IUPAC name of (6-cyclohexyloxy-3-pyridinyl)methanamine (CID 16781318) is (6-cyclohexyloxy-3-pyridinyl)methanamine.
What is the SMILES notation for (6-cyclohexyloxy-3-pyridinyl)methanamine?
The canonical SMILES for (6-cyclohexyloxy-3-pyridinyl)methanamine is NCc1ccc(OC2CCCCC2)nc1.
What is the InChIKey of (6-cyclohexyloxy-3-pyridinyl)methanamine?
The InChIKey is KBEXCOQBYDIUNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c13-8-10-6-7-12(14-9-10)15-11-4-2-1-3-5-11/h6-7,9,11H,1-5,8,13H2.
What are the key properties of (6-cyclohexyloxy-3-pyridinyl)methanamine?
(6-cyclohexyloxy-3-pyridinyl)methanamine has a molecular weight of 206.29 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-cyclohexyloxy-3-pyridinyl)methanamine is sourced from PubChem (CID 16781318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).