3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide

C11H12N4O2 — CID 113447693

IUPAC3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide
SMILESCc1cc(CNC(=O)c2ncccc2N)no1
InChIInChI=1S/C11H12N4O2/c1-7-5-8(15-17-7)6-14-11(16)10-9(12)3-2-4-13-10/h2-5H,6,12H2,1H3,(H,14,16)
InChIKeyNSFWSNYUICGOMK-UHFFFAOYSA-N
MW232.24 g/mol
LogP0.89
Rot. Bonds3

About 3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide

3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide (PubChem CID 113447693) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide
PubChem CID113447693
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide
SMILESCc1cc(CNC(=O)c2ncccc2N)no1
InChIInChI=1S/C11H12N4O2/c1-7-5-8(15-17-7)6-14-11(16)10-9(12)3-2-4-13-10/h2-5H,6,12H2,1H3,(H,14,16)
InChIKeyNSFWSNYUICGOMK-UHFFFAOYSA-N
XLogP0.89
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-4-carboxamide
CID 55041801
6-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-3-carboxamide
CID 62160023
3-amino-N-(pyridazin-3-ylmethyl)pyridine-2-carboxamide
CID 106896014
4-amino-3-methoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]benzamide
CID 89340281
3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-nitrobenzamide
CID 115548682
2-amino-4-fluoro-N-[(5-methyl-1,2-oxazol-3-yl)methyl]benzamide
CID 63110385
2-amino-4-bromo-N-[(5-methyl-1,2-oxazol-3-yl)methyl]benzamide
CID 79722571
5-methyl-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide
CID 2971561
3-amino-2-[(5-methyl-1,2-oxazol-3-yl)methylamino]benzoic acid
CID 112578662
3,4-diethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]benzamide
CID 47900987
3-amino-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide
CID 104742770
3,5-dihydroxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]benzamide
CID 104938925

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide (CID 113447693) is 3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide is Cc1cc(CNC(=O)c2ncccc2N)no1.
What is the InChIKey of 3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide?
The InChIKey is NSFWSNYUICGOMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c1-7-5-8(15-17-7)6-14-11(16)10-9(12)3-2-4-13-10/h2-5H,6,12H2,1H3,(H,14,16).
What are the key properties of 3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide?
3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide has a molecular weight of 232.24 g/mol, XLogP of 0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 113447693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).