2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide

C15H16N2OS — CID 9174069

IUPAC2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide
SMILESNC(=O)Cc1nc(-c2ccc3c(c2)CCCC3)cs1
InChIInChI=1S/C15H16N2OS/c16-14(18)8-15-17-13(9-19-15)12-6-5-10-3-1-2-4-11(10)7-12/h5-7,9H,1-4,8H2,(H2,16,18)
InChIKeyKZULWHKDTNIJNY-UHFFFAOYSA-N
MW272.37 g/mol
LogP2.72
Rot. Bonds3

About 2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide

2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide (PubChem CID 9174069) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is 2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound Name2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide
PubChem CID9174069
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC Name2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide
SMILESNC(=O)Cc1nc(-c2ccc3c(c2)CCCC3)cs1
InChIInChI=1S/C15H16N2OS/c16-14(18)8-15-17-13(9-19-15)12-6-5-10-3-1-2-4-11(10)7-12/h5-7,9H,1-4,8H2,(H2,16,18)
InChIKeyKZULWHKDTNIJNY-UHFFFAOYSA-N
XLogP2.72
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-2-yl]methanol
CID 71998381
2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]acetamide
CID 9174003
2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]acetamide
CID 9173965
2-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]acetamide
CID 116970137
2-[4-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-2-yl]acetic acid
CID 116965649
2-[[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]methoxy]benzoic acid
CID 20983524
2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]acetamide
CID 82118916
N-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]propanamide
CID 4142849
2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 25653
2-[6-(2,3-dihydro-1H-inden-5-yl)-1,2,4-triazin-3-yl]acetamide
CID 82381300
2-[4-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-2-yl]-N-methylethanamine
CID 82089636
2-amino-2-methyl-N-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]propanamide
CID 119264633

Frequently Asked Questions

What is the IUPAC name of 2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of 2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide (CID 9174069) is 2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for 2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for 2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide is NC(=O)Cc1nc(-c2ccc3c(c2)CCCC3)cs1.
What is the InChIKey of 2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide?
The InChIKey is KZULWHKDTNIJNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c16-14(18)8-15-17-13(9-19-15)12-6-5-10-3-1-2-4-11(10)7-12/h5-7,9H,1-4,8H2,(H2,16,18).
What are the key properties of 2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide?
2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 272.37 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 9174069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).