N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide

C11H15N3O — CID 119515078

IUPACN-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide
SMILESNc1ccc(NC(=O)CCC2CC2)cn1
InChIInChI=1S/C11H15N3O/c12-10-5-4-9(7-13-10)14-11(15)6-3-8-1-2-8/h4-5,7-8H,1-3,6H2,(H2,12,13)(H,14,15)
InChIKeyWXWBNCFUKJMBNN-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.79
Rot. Bonds4

About N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide

N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide (PubChem CID 119515078) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide
PubChem CID119515078
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC NameN-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide
SMILESNc1ccc(NC(=O)CCC2CC2)cn1
InChIInChI=1S/C11H15N3O/c12-10-5-4-9(7-13-10)14-11(15)6-3-8-1-2-8/h4-5,7-8H,1-3,6H2,(H2,12,13)(H,14,15)
InChIKeyWXWBNCFUKJMBNN-UHFFFAOYSA-N
XLogP1.79
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide?
The IUPAC name of N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide (CID 119515078) is N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide?
The canonical SMILES for N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide is Nc1ccc(NC(=O)CCC2CC2)cn1.
What is the InChIKey of N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide?
The InChIKey is WXWBNCFUKJMBNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c12-10-5-4-9(7-13-10)14-11(15)6-3-8-1-2-8/h4-5,7-8H,1-3,6H2,(H2,12,13)(H,14,15).
What are the key properties of N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide?
N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide has a molecular weight of 205.26 g/mol, XLogP of 1.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide is sourced from PubChem (CID 119515078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).