2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine

C14H24N2O2 — CID 116718601

IUPAC2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine
SMILESCCCC(OC)C(N)c1cncc(OC(C)C)c1
InChIInChI=1S/C14H24N2O2/c1-5-6-13(17-4)14(15)11-7-12(9-16-8-11)18-10(2)3/h7-10,13-14H,5-6,15H2,1-4H3
InChIKeyHNCUSIGLYJHUQZ-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.68
Rot. Bonds7

About 2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine

2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine (PubChem CID 116718601) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine.

Molecular Properties

Compound Name2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine
PubChem CID116718601
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine
SMILESCCCC(OC)C(N)c1cncc(OC(C)C)c1
InChIInChI=1S/C14H24N2O2/c1-5-6-13(17-4)14(15)11-7-12(9-16-8-11)18-10(2)3/h7-10,13-14H,5-6,15H2,1-4H3
InChIKeyHNCUSIGLYJHUQZ-UHFFFAOYSA-N
XLogP2.68
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine?
The IUPAC name of 2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine (CID 116718601) is 2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine.
What is the SMILES notation for 2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine?
The canonical SMILES for 2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine is CCCC(OC)C(N)c1cncc(OC(C)C)c1.
What is the InChIKey of 2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine?
The InChIKey is HNCUSIGLYJHUQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-5-6-13(17-4)14(15)11-7-12(9-16-8-11)18-10(2)3/h7-10,13-14H,5-6,15H2,1-4H3.
What are the key properties of 2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine?
2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine has a molecular weight of 252.36 g/mol, XLogP of 2.68, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine is sourced from PubChem (CID 116718601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).