2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine

C14H21N3O2S — CID 79552337

IUPAC2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine
SMILESCc1nc2ccccn2c1CNCC(C)(C)S(C)(=O)=O
InChIInChI=1S/C14H21N3O2S/c1-11-12(17-8-6-5-7-13(17)16-11)9-15-10-14(2,3)20(4,18)19/h5-8,15H,9-10H2,1-4H3
InChIKeyWKPRWMGYLSTTKE-UHFFFAOYSA-N
MW295.41 g/mol
LogP1.56
Rot. Bonds5

About 2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine

2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine (PubChem CID 79552337) has the molecular formula C14H21N3O2S and a molecular weight of 295.41 g/mol. Its IUPAC name is 2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine
PubChem CID79552337
Molecular FormulaC14H21N3O2S
Molecular Weight295.41 g/mol
Exact Mass295.14
IUPAC Name2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine
SMILESCc1nc2ccccn2c1CNCC(C)(C)S(C)(=O)=O
InChIInChI=1S/C14H21N3O2S/c1-11-12(17-8-6-5-7-13(17)16-11)9-15-10-14(2,3)20(4,18)19/h5-8,15H,9-10H2,1-4H3
InChIKeyWKPRWMGYLSTTKE-UHFFFAOYSA-N
XLogP1.56
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine?
The IUPAC name of 2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine (CID 79552337) is 2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine.
What is the SMILES notation for 2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine?
The canonical SMILES for 2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine is Cc1nc2ccccn2c1CNCC(C)(C)S(C)(=O)=O.
What is the InChIKey of 2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine?
The InChIKey is WKPRWMGYLSTTKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2S/c1-11-12(17-8-6-5-7-13(17)16-11)9-15-10-14(2,3)20(4,18)19/h5-8,15H,9-10H2,1-4H3.
What are the key properties of 2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine?
2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine has a molecular weight of 295.41 g/mol, XLogP of 1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylsulfonylpropan-1-amine is sourced from PubChem (CID 79552337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).