(1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine

C14H24N2O — CID 130465973

IUPAC(1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine
SMILESCOc1ccc([C@@H]([C@H](C)C(C)C)N(C)C)cn1
InChIInChI=1S/C14H24N2O/c1-10(2)11(3)14(16(4)5)12-7-8-13(17-6)15-9-12/h7-11,14H,1-6H3/t11-,14-/m1/s1
InChIKeyOXOZVNDLDKRTJU-BXUZGUMPSA-N
MW236.36 g/mol
LogP2.98
Rot. Bonds5

About (1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine

(1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine (PubChem CID 130465973) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is (1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine.

Molecular Properties

Compound Name(1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine
PubChem CID130465973
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name(1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine
SMILESCOc1ccc([C@@H]([C@H](C)C(C)C)N(C)C)cn1
InChIInChI=1S/C14H24N2O/c1-10(2)11(3)14(16(4)5)12-7-8-13(17-6)15-9-12/h7-11,14H,1-6H3/t11-,14-/m1/s1
InChIKeyOXOZVNDLDKRTJU-BXUZGUMPSA-N
XLogP2.98
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine?
The IUPAC name of (1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine (CID 130465973) is (1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine.
What is the SMILES notation for (1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine?
The canonical SMILES for (1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine is COc1ccc([C@@H]([C@H](C)C(C)C)N(C)C)cn1.
What is the InChIKey of (1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine?
The InChIKey is OXOZVNDLDKRTJU-BXUZGUMPSA-N. The full InChI is InChI=1S/C14H24N2O/c1-10(2)11(3)14(16(4)5)12-7-8-13(17-6)15-9-12/h7-11,14H,1-6H3/t11-,14-/m1/s1.
What are the key properties of (1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine?
(1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine has a molecular weight of 236.36 g/mol, XLogP of 2.98, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R)-1-(6-methoxy-3-pyridinyl)-N,N,2,3-tetramethylbutan-1-amine is sourced from PubChem (CID 130465973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).