2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide

C8H12N2OS — CID 146397984

IUPAC2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide
SMILESCC(C)(C)C(=O)Nc1cscn1
InChIInChI=1S/C8H12N2OS/c1-8(2,3)7(11)10-6-4-12-5-9-6/h4-5H,1-3H3,(H,10,11)
InChIKeyIHBRYEHNCJABDM-UHFFFAOYSA-N
MW184.26 g/mol
LogP2.13
Rot. Bonds1

About 2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide

2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide (PubChem CID 146397984) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is 2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide
PubChem CID146397984
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC Name2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide
SMILESCC(C)(C)C(=O)Nc1cscn1
InChIInChI=1S/C8H12N2OS/c1-8(2,3)7(11)10-6-4-12-5-9-6/h4-5H,1-3H3,(H,10,11)
InChIKeyIHBRYEHNCJABDM-UHFFFAOYSA-N
XLogP2.13
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,3-thiazol-4-yl)prop-2-ynamide
CID 45121900
S-propyl N-(1,3-thiazol-4-yl)carbamothioate
CID 130008086
ethane;prop-2-enyl N-(1,3-thiazol-4-yl)carbamate
CID 91362137
N-(5-tert-butyl-2-pyridinyl)-2,2-dimethylpropanamide
CID 58417149
N-(5-chloropyrazin-2-yl)-2,2-dimethylpropanamide
CID 107595750
2,2-dimethyl-N-(6-phosphanyl-2-pyridinyl)propanamide
CID 70898428
2,2-dimethyl-N-(1,3,4-thiadiazol-2-yl)propanamide
CID 3453475
2-(1,3-thiazol-4-ylamino)ethanol
CID 54482134
N-(1,3-thiazol-4-yl)methanesulfonamide
CID 135331205
N-[6-(2-aminopropan-2-yl)-3-pyridinyl]-2,2-dimethylpropanamide
CID 123487385
N-(6-hydroxyquinolin-2-yl)-2,2-dimethylpropanamide
CID 146492851
2,2-dimethyl-N-[4-(trichloromethyl)-2-pyridinyl]propanamide
CID 15156839

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide?
The IUPAC name of 2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide (CID 146397984) is 2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide?
The canonical SMILES for 2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide is CC(C)(C)C(=O)Nc1cscn1.
What is the InChIKey of 2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide?
The InChIKey is IHBRYEHNCJABDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-8(2,3)7(11)10-6-4-12-5-9-6/h4-5H,1-3H3,(H,10,11).
What are the key properties of 2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide?
2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide has a molecular weight of 184.26 g/mol, XLogP of 2.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(1,3-thiazol-4-yl)propanamide is sourced from PubChem (CID 146397984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).