3-amino-N-ethyl-N-propylpyridine-2-carboxamide

C11H17N3O — CID 104741010

IUPAC3-amino-N-ethyl-N-propylpyridine-2-carboxamide
SMILESCCCN(CC)C(=O)c1ncccc1N
InChIInChI=1S/C11H17N3O/c1-3-8-14(4-2)11(15)10-9(12)6-5-7-13-10/h5-7H,3-4,8,12H2,1-2H3
InChIKeyZUIXIZGVRMGZEQ-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.54
Rot. Bonds4

About 3-amino-N-ethyl-N-propylpyridine-2-carboxamide

3-amino-N-ethyl-N-propylpyridine-2-carboxamide (PubChem CID 104741010) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 3-amino-N-ethyl-N-propylpyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-ethyl-N-propylpyridine-2-carboxamide
PubChem CID104741010
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name3-amino-N-ethyl-N-propylpyridine-2-carboxamide
SMILESCCCN(CC)C(=O)c1ncccc1N
InChIInChI=1S/C11H17N3O/c1-3-8-14(4-2)11(15)10-9(12)6-5-7-13-10/h5-7H,3-4,8,12H2,1-2H3
InChIKeyZUIXIZGVRMGZEQ-UHFFFAOYSA-N
XLogP1.54
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-ethyl-N-propylpyridine-2-carboxamide?
The IUPAC name of 3-amino-N-ethyl-N-propylpyridine-2-carboxamide (CID 104741010) is 3-amino-N-ethyl-N-propylpyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-ethyl-N-propylpyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-ethyl-N-propylpyridine-2-carboxamide is CCCN(CC)C(=O)c1ncccc1N.
What is the InChIKey of 3-amino-N-ethyl-N-propylpyridine-2-carboxamide?
The InChIKey is ZUIXIZGVRMGZEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-3-8-14(4-2)11(15)10-9(12)6-5-7-13-10/h5-7H,3-4,8,12H2,1-2H3.
What are the key properties of 3-amino-N-ethyl-N-propylpyridine-2-carboxamide?
3-amino-N-ethyl-N-propylpyridine-2-carboxamide has a molecular weight of 207.28 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-ethyl-N-propylpyridine-2-carboxamide is sourced from PubChem (CID 104741010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).