[5-(2-methylpropoxy)-2-pyridinyl]methanamine

C10H16N2O — CID 79787202

IUPAC[5-(2-methylpropoxy)-2-pyridinyl]methanamine
SMILESCC(C)COc1ccc(CN)nc1
InChIInChI=1S/C10H16N2O/c1-8(2)7-13-10-4-3-9(5-11)12-6-10/h3-4,6,8H,5,7,11H2,1-2H3
InChIKeyDLERWCNLBVNRFQ-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.58
Rot. Bonds4

About [5-(2-methylpropoxy)-2-pyridinyl]methanamine

[5-(2-methylpropoxy)-2-pyridinyl]methanamine (PubChem CID 79787202) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is [5-(2-methylpropoxy)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[5-(2-methylpropoxy)-2-pyridinyl]methanamine
PubChem CID79787202
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name[5-(2-methylpropoxy)-2-pyridinyl]methanamine
SMILESCC(C)COc1ccc(CN)nc1
InChIInChI=1S/C10H16N2O/c1-8(2)7-13-10-4-3-9(5-11)12-6-10/h3-4,6,8H,5,7,11H2,1-2H3
InChIKeyDLERWCNLBVNRFQ-UHFFFAOYSA-N
XLogP1.58
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine
CID 79799793
N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine
CID 79775957
(5-butoxy-2-pyridinyl)methanamine
CID 79787452
N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine
CID 83127836
2-[[6-(aminomethyl)-3-pyridinyl]oxy]-1-phenylethanol
CID 79776187
[6-(2-methylpropoxy)pyridazin-3-yl]methanamine
CID 62292495
(5-prop-2-ynoxy-2-pyridinyl)methanamine
CID 79776533
N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]propan-1-amine
CID 112584711
[5-(2-propoxyethoxy)-2-pyridinyl]methanamine
CID 115487193
2-[[6-(aminomethyl)-3-pyridinyl]oxy]-1-(3-methoxyphenyl)ethanol
CID 81134459
[5-[4-(2-methylpropoxy)phenyl]-1H-imidazol-2-yl]methanamine
CID 95457106
2-amino-1-[4-(2-methylpropoxy)phenyl]ethanol
CID 102533878

Frequently Asked Questions

What is the IUPAC name of [5-(2-methylpropoxy)-2-pyridinyl]methanamine?
The IUPAC name of [5-(2-methylpropoxy)-2-pyridinyl]methanamine (CID 79787202) is [5-(2-methylpropoxy)-2-pyridinyl]methanamine.
What is the SMILES notation for [5-(2-methylpropoxy)-2-pyridinyl]methanamine?
The canonical SMILES for [5-(2-methylpropoxy)-2-pyridinyl]methanamine is CC(C)COc1ccc(CN)nc1.
What is the InChIKey of [5-(2-methylpropoxy)-2-pyridinyl]methanamine?
The InChIKey is DLERWCNLBVNRFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-8(2)7-13-10-4-3-9(5-11)12-6-10/h3-4,6,8H,5,7,11H2,1-2H3.
What are the key properties of [5-(2-methylpropoxy)-2-pyridinyl]methanamine?
[5-(2-methylpropoxy)-2-pyridinyl]methanamine has a molecular weight of 180.25 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-methylpropoxy)-2-pyridinyl]methanamine is sourced from PubChem (CID 79787202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).