(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine

C12H16ClN3 — CID 39199530

IUPAC(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine
SMILESCC(C)(C)c1nc2ccc(Cl)cn2c1CN
InChIInChI=1S/C12H16ClN3/c1-12(2,3)11-9(6-14)16-7-8(13)4-5-10(16)15-11/h4-5,7H,6,14H2,1-3H3
InChIKeyIEGVCSHBKLYKNT-UHFFFAOYSA-N
MW237.73 g/mol
LogP2.74
Rot. Bonds1

About (2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine

(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine (PubChem CID 39199530) has the molecular formula C12H16ClN3 and a molecular weight of 237.73 g/mol. Its IUPAC name is (2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine.

Molecular Properties

Compound Name(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine
PubChem CID39199530
Molecular FormulaC12H16ClN3
Molecular Weight237.73 g/mol
Exact Mass237.10
IUPAC Name(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine
SMILESCC(C)(C)c1nc2ccc(Cl)cn2c1CN
InChIInChI=1S/C12H16ClN3/c1-12(2,3)11-9(6-14)16-7-8(13)4-5-10(16)15-11/h4-5,7H,6,14H2,1-3H3
InChIKeyIEGVCSHBKLYKNT-UHFFFAOYSA-N
XLogP2.74
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.73
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine?
The IUPAC name of (2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine (CID 39199530) is (2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine.
What is the SMILES notation for (2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine?
The canonical SMILES for (2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine is CC(C)(C)c1nc2ccc(Cl)cn2c1CN.
What is the InChIKey of (2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine?
The InChIKey is IEGVCSHBKLYKNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN3/c1-12(2,3)11-9(6-14)16-7-8(13)4-5-10(16)15-11/h4-5,7H,6,14H2,1-3H3.
What are the key properties of (2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine?
(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine has a molecular weight of 237.73 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)methanamine is sourced from PubChem (CID 39199530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).