1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine

C12H20N2O — CID 112584694

IUPAC1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine
SMILESCCCNC(CC)c1ccc(OC)cn1
InChIInChI=1S/C12H20N2O/c1-4-8-13-11(5-2)12-7-6-10(15-3)9-14-12/h6-7,9,11,13H,4-5,8H2,1-3H3
InChIKeySYIQNEOMWMQZIA-UHFFFAOYSA-N
MW208.31 g/mol
LogP2.54
Rot. Bonds6

About 1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine

1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine (PubChem CID 112584694) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine.

Molecular Properties

Compound Name1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine
PubChem CID112584694
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC Name1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine
SMILESCCCNC(CC)c1ccc(OC)cn1
InChIInChI=1S/C12H20N2O/c1-4-8-13-11(5-2)12-7-6-10(15-3)9-14-12/h6-7,9,11,13H,4-5,8H2,1-3H3
InChIKeySYIQNEOMWMQZIA-UHFFFAOYSA-N
XLogP2.54
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-ethoxy-2-pyridinyl)-N-propylpropan-1-amine
CID 112584697
1-(5-propan-2-yloxy-2-pyridinyl)-N-propylpropan-1-amine
CID 112584724
1-(5-phenoxy-2-pyridinyl)-N-propylpropan-1-amine
CID 115939962
1-[5-(2-propoxyethoxy)-2-pyridinyl]-N-propylpropan-1-amine
CID 115940129
N-propyl-1-(5-pyridin-3-yloxy-2-pyridinyl)propan-1-amine
CID 115940028
1-(5-cyclobutyloxy-2-pyridinyl)-N-propylpropan-1-amine
CID 112584886
1-(5-cyclopentyloxy-2-pyridinyl)-N-propylpropan-1-amine
CID 112584681
1-[5-(2-methylcyclohexyl)oxy-2-pyridinyl]-N-propylpropan-1-amine
CID 115939879
N,N-dipropyl-6-[1-(propylamino)propyl]pyridin-3-amine
CID 115939175
1-[5-(oxolan-2-ylmethoxy)-2-pyridinyl]-N-propylpropan-1-amine
CID 115939887
N-cyclopropyl-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine
CID 112584130
1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]-N-propylpropan-1-amine
CID 115939163

Frequently Asked Questions

What is the IUPAC name of 1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine?
The IUPAC name of 1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine (CID 112584694) is 1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine.
What is the SMILES notation for 1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine?
The canonical SMILES for 1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine is CCCNC(CC)c1ccc(OC)cn1.
What is the InChIKey of 1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine?
The InChIKey is SYIQNEOMWMQZIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-4-8-13-11(5-2)12-7-6-10(15-3)9-14-12/h6-7,9,11,13H,4-5,8H2,1-3H3.
What are the key properties of 1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine?
1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine has a molecular weight of 208.31 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine is sourced from PubChem (CID 112584694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).