N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide

C10H13N3O — CID 79044396

IUPACN-(2-methyl-3-pyridinyl)azetidine-3-carboxamide
SMILESCc1ncccc1NC(=O)C1CNC1
InChIInChI=1S/C10H13N3O/c1-7-9(3-2-4-12-7)13-10(14)8-5-11-6-8/h2-4,8,11H,5-6H2,1H3,(H,13,14)
InChIKeyDAJWWSUFMNWHBG-UHFFFAOYSA-N
MW191.23 g/mol
LogP0.55
Rot. Bonds2

About N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide

N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide (PubChem CID 79044396) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-3-pyridinyl)azetidine-3-carboxamide
PubChem CID79044396
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC NameN-(2-methyl-3-pyridinyl)azetidine-3-carboxamide
SMILESCc1ncccc1NC(=O)C1CNC1
InChIInChI=1S/C10H13N3O/c1-7-9(3-2-4-12-7)13-10(14)8-5-11-6-8/h2-4,8,11H,5-6H2,1H3,(H,13,14)
InChIKeyDAJWWSUFMNWHBG-UHFFFAOYSA-N
XLogP0.55
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide?
The IUPAC name of N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide (CID 79044396) is N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide.
What is the SMILES notation for N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide?
The canonical SMILES for N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide is Cc1ncccc1NC(=O)C1CNC1.
What is the InChIKey of N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide?
The InChIKey is DAJWWSUFMNWHBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-7-9(3-2-4-12-7)13-10(14)8-5-11-6-8/h2-4,8,11H,5-6H2,1H3,(H,13,14).
What are the key properties of N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide?
N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide has a molecular weight of 191.23 g/mol, XLogP of 0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide is sourced from PubChem (CID 79044396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).