5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine

C15H25N3 — CID 104535710

IUPAC5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine
SMILESCCCNc1cncc(N2C(C)CCC2CC)c1
InChIInChI=1S/C15H25N3/c1-4-8-17-13-9-15(11-16-10-13)18-12(3)6-7-14(18)5-2/h9-12,14,17H,4-8H2,1-3H3
InChIKeyQHICBWDJOJBXEA-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.67
Rot. Bonds5

About 5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine

5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine (PubChem CID 104535710) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine.

Molecular Properties

Compound Name5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine
PubChem CID104535710
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine
SMILESCCCNc1cncc(N2C(C)CCC2CC)c1
InChIInChI=1S/C15H25N3/c1-4-8-17-13-9-15(11-16-10-13)18-12(3)6-7-14(18)5-2/h9-12,14,17H,4-8H2,1-3H3
InChIKeyQHICBWDJOJBXEA-UHFFFAOYSA-N
XLogP3.67
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine?
The IUPAC name of 5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine (CID 104535710) is 5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine.
What is the SMILES notation for 5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine?
The canonical SMILES for 5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine is CCCNc1cncc(N2C(C)CCC2CC)c1.
What is the InChIKey of 5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine?
The InChIKey is QHICBWDJOJBXEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-8-17-13-9-15(11-16-10-13)18-12(3)6-7-14(18)5-2/h9-12,14,17H,4-8H2,1-3H3.
What are the key properties of 5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine?
5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine has a molecular weight of 247.39 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine is sourced from PubChem (CID 104535710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).