(6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine

C10H16N2O — CID 79163718

IUPAC(6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine
SMILESCc1ccc(OC(C)C)c(CN)n1
InChIInChI=1S/C10H16N2O/c1-7(2)13-10-5-4-8(3)12-9(10)6-11/h4-5,7H,6,11H2,1-3H3
InChIKeyZHMWWYFGXUPHTG-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.64
Rot. Bonds3

About (6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine

(6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine (PubChem CID 79163718) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is (6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine.

Molecular Properties

Compound Name(6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine
PubChem CID79163718
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name(6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine
SMILESCc1ccc(OC(C)C)c(CN)n1
InChIInChI=1S/C10H16N2O/c1-7(2)13-10-5-4-8(3)12-9(10)6-11/h4-5,7H,6,11H2,1-3H3
InChIKeyZHMWWYFGXUPHTG-UHFFFAOYSA-N
XLogP1.64
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine?
The IUPAC name of (6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine (CID 79163718) is (6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine.
What is the SMILES notation for (6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine?
The canonical SMILES for (6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine is Cc1ccc(OC(C)C)c(CN)n1.
What is the InChIKey of (6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine?
The InChIKey is ZHMWWYFGXUPHTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-7(2)13-10-5-4-8(3)12-9(10)6-11/h4-5,7H,6,11H2,1-3H3.
What are the key properties of (6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine?
(6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine has a molecular weight of 180.25 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-3-propan-2-yloxy-2-pyridinyl)methanamine is sourced from PubChem (CID 79163718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).