[5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine

C11H13N3OS — CID 106923770

IUPAC[5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine
SMILESCc1nc(Sc2ccc(CN)nc2)oc1C
InChIInChI=1S/C11H13N3OS/c1-7-8(2)15-11(14-7)16-10-4-3-9(5-12)13-6-10/h3-4,6H,5,12H2,1-2H3
InChIKeyQUABDPJSJPJARO-UHFFFAOYSA-N
MW235.31 g/mol
LogP2.30
Rot. Bonds3

About [5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine

[5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine (PubChem CID 106923770) has the molecular formula C11H13N3OS and a molecular weight of 235.31 g/mol. Its IUPAC name is [5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine
PubChem CID106923770
Molecular FormulaC11H13N3OS
Molecular Weight235.31 g/mol
Exact Mass235.08
IUPAC Name[5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine
SMILESCc1nc(Sc2ccc(CN)nc2)oc1C
InChIInChI=1S/C11H13N3OS/c1-7-8(2)15-11(14-7)16-10-4-3-9(5-12)13-6-10/h3-4,6H,5,12H2,1-2H3
InChIKeyQUABDPJSJPJARO-UHFFFAOYSA-N
XLogP2.30
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.31
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[5-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-2-pyridinyl]methanamine
CID 113321430
5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-methylaniline
CID 106921620
1-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]phenyl]ethanone
CID 106923049
2-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]pyrimidine-5-carbaldehyde
CID 106926411
4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-N'-hydroxybenzenecarboximidamide
CID 113228227
2-amino-5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]benzamide
CID 106924162
[5-[(3,5-dimethylphenyl)methylsulfanyl]-2-pyridinyl]methanamine
CID 113321432
[4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-3-(trifluoromethyl)phenyl]methanamine
CID 106926807
1-[6-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-3-pyridinyl]propan-2-amine
CID 106927161
3-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoroaniline
CID 106921680
2-(3-ethoxy-4-nitrophenyl)sulfanyl-4,5-dimethyl-1,3-oxazole
CID 133426823
[5-(3-methoxypropylsulfanyl)-2-pyridinyl]methanamine
CID 115490313

Frequently Asked Questions

What is the IUPAC name of [5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine?
The IUPAC name of [5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine (CID 106923770) is [5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine.
What is the SMILES notation for [5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine?
The canonical SMILES for [5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine is Cc1nc(Sc2ccc(CN)nc2)oc1C.
What is the InChIKey of [5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine?
The InChIKey is QUABDPJSJPJARO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3OS/c1-7-8(2)15-11(14-7)16-10-4-3-9(5-12)13-6-10/h3-4,6H,5,12H2,1-2H3.
What are the key properties of [5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine?
[5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine has a molecular weight of 235.31 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-2-pyridinyl]methanamine is sourced from PubChem (CID 106923770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).