[2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone

C14H15N5OS — CID 162644878

IUPAC[2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone
SMILESCc1ccn2c(C(=O)c3sc(N)nc3N(C)C)cnc2c1
InChIInChI=1S/C14H15N5OS/c1-8-4-5-19-9(7-16-10(19)6-8)11(20)12-13(18(2)3)17-14(15)21-12/h4-7H,1-3H3,(H2,15,17)
InChIKeyURVZXXFCHXAFAZ-UHFFFAOYSA-N
MW301.38 g/mol
LogP1.98
Rot. Bonds3

About [2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone

[2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone (PubChem CID 162644878) has the molecular formula C14H15N5OS and a molecular weight of 301.38 g/mol. Its IUPAC name is [2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone.

Molecular Properties

Compound Name[2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone
PubChem CID162644878
Molecular FormulaC14H15N5OS
Molecular Weight301.38 g/mol
Exact Mass301.10
IUPAC Name[2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone
SMILESCc1ccn2c(C(=O)c3sc(N)nc3N(C)C)cnc2c1
InChIInChI=1S/C14H15N5OS/c1-8-4-5-19-9(7-16-10(19)6-8)11(20)12-13(18(2)3)17-14(15)21-12/h4-7H,1-3H3,(H2,15,17)
InChIKeyURVZXXFCHXAFAZ-UHFFFAOYSA-N
XLogP1.98
TPSA76.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.38
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of [2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone?
The IUPAC name of [2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone (CID 162644878) is [2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone.
What is the SMILES notation for [2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone?
The canonical SMILES for [2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone is Cc1ccn2c(C(=O)c3sc(N)nc3N(C)C)cnc2c1.
What is the InChIKey of [2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone?
The InChIKey is URVZXXFCHXAFAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5OS/c1-8-4-5-19-9(7-16-10(19)6-8)11(20)12-13(18(2)3)17-14(15)21-12/h4-7H,1-3H3,(H2,15,17).
What are the key properties of [2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone?
[2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone has a molecular weight of 301.38 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-amino-4-(dimethylamino)-1,3-thiazol-5-yl]-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone is sourced from PubChem (CID 162644878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).