6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine

C15H25N3O — CID 83122915

IUPAC6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine
SMILESCCNC(C)c1ccc(N(C)CC2CCCO2)cn1
InChIInChI=1S/C15H25N3O/c1-4-16-12(2)15-8-7-13(10-17-15)18(3)11-14-6-5-9-19-14/h7-8,10,12,14,16H,4-6,9,11H2,1-3H3
InChIKeyRXTZQUFRWLMUHU-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.37
Rot. Bonds6

About 6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine

6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine (PubChem CID 83122915) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine.

Molecular Properties

Compound Name6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine
PubChem CID83122915
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine
SMILESCCNC(C)c1ccc(N(C)CC2CCCO2)cn1
InChIInChI=1S/C15H25N3O/c1-4-16-12(2)15-8-7-13(10-17-15)18(3)11-14-6-5-9-19-14/h7-8,10,12,14,16H,4-6,9,11H2,1-3H3
InChIKeyRXTZQUFRWLMUHU-UHFFFAOYSA-N
XLogP2.37
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine?
The IUPAC name of 6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine (CID 83122915) is 6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine.
What is the SMILES notation for 6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine?
The canonical SMILES for 6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine is CCNC(C)c1ccc(N(C)CC2CCCO2)cn1.
What is the InChIKey of 6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine?
The InChIKey is RXTZQUFRWLMUHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-16-12(2)15-8-7-13(10-17-15)18(3)11-14-6-5-9-19-14/h7-8,10,12,14,16H,4-6,9,11H2,1-3H3.
What are the key properties of 6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine?
6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine has a molecular weight of 263.38 g/mol, XLogP of 2.37, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(ethylamino)ethyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-3-amine is sourced from PubChem (CID 83122915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).