6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine

C13H21N3O — CID 107340376

IUPAC6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine
SMILESCC(NCCc1ccc(N)cn1)C1CCOC1
InChIInChI=1S/C13H21N3O/c1-10(11-5-7-17-9-11)15-6-4-13-3-2-12(14)8-16-13/h2-3,8,10-11,15H,4-7,9,14H2,1H3
InChIKeyRIDPPKQHUCYYNU-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.22
Rot. Bonds5

About 6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine

6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine (PubChem CID 107340376) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine.

Molecular Properties

Compound Name6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine
PubChem CID107340376
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine
SMILESCC(NCCc1ccc(N)cn1)C1CCOC1
InChIInChI=1S/C13H21N3O/c1-10(11-5-7-17-9-11)15-6-4-13-3-2-12(14)8-16-13/h2-3,8,10-11,15H,4-7,9,14H2,1H3
InChIKeyRIDPPKQHUCYYNU-UHFFFAOYSA-N
XLogP1.22
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine?
The IUPAC name of 6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine (CID 107340376) is 6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine.
What is the SMILES notation for 6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine?
The canonical SMILES for 6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine is CC(NCCc1ccc(N)cn1)C1CCOC1.
What is the InChIKey of 6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine?
The InChIKey is RIDPPKQHUCYYNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-10(11-5-7-17-9-11)15-6-4-13-3-2-12(14)8-16-13/h2-3,8,10-11,15H,4-7,9,14H2,1H3.
What are the key properties of 6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine?
6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine has a molecular weight of 235.33 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[1-(oxolan-3-yl)ethylamino]ethyl]pyridin-3-amine is sourced from PubChem (CID 107340376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).