4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide

C10H13N3O2 — CID 154029220

IUPAC4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide
SMILESCC1(Nc2ccncc2C(N)=O)COC1
InChIInChI=1S/C10H13N3O2/c1-10(5-15-6-10)13-8-2-3-12-4-7(8)9(11)14/h2-4H,5-6H2,1H3,(H2,11,14)(H,12,13)
InChIKeyGEUYDNJOTVAATQ-UHFFFAOYSA-N
MW207.23 g/mol
LogP0.38
Rot. Bonds3

About 4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide

4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide (PubChem CID 154029220) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide
PubChem CID154029220
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide
SMILESCC1(Nc2ccncc2C(N)=O)COC1
InChIInChI=1S/C10H13N3O2/c1-10(5-15-6-10)13-8-2-3-12-4-7(8)9(11)14/h2-4H,5-6H2,1H3,(H2,11,14)(H,12,13)
InChIKeyGEUYDNJOTVAATQ-UHFFFAOYSA-N
XLogP0.38
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide?
The IUPAC name of 4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide (CID 154029220) is 4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide.
What is the SMILES notation for 4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide?
The canonical SMILES for 4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide is CC1(Nc2ccncc2C(N)=O)COC1.
What is the InChIKey of 4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide?
The InChIKey is GEUYDNJOTVAATQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c1-10(5-15-6-10)13-8-2-3-12-4-7(8)9(11)14/h2-4H,5-6H2,1H3,(H2,11,14)(H,12,13).
What are the key properties of 4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide?
4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide has a molecular weight of 207.23 g/mol, XLogP of 0.38, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 154029220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).