2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide

C10H16N2OS — CID 104578837

IUPAC2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide
SMILESCC(C)C(=O)NCC(C)c1nccs1
InChIInChI=1S/C10H16N2OS/c1-7(2)9(13)12-6-8(3)10-11-4-5-14-10/h4-5,7-8H,6H2,1-3H3,(H,12,13)
InChIKeyQRATZIQKZFTNGM-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.02
Rot. Bonds4

About 2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide

2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide (PubChem CID 104578837) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide
PubChem CID104578837
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide
SMILESCC(C)C(=O)NCC(C)c1nccs1
InChIInChI=1S/C10H16N2OS/c1-7(2)9(13)12-6-8(3)10-11-4-5-14-10/h4-5,7-8H,6H2,1-3H3,(H,12,13)
InChIKeyQRATZIQKZFTNGM-UHFFFAOYSA-N
XLogP2.02
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-4-methyl-N-[2-(1,3-thiazol-2-yl)propyl]pentanamide
CID 114127505
2-(2-hydroxyphenyl)-N-[2-(1,3-thiazol-2-yl)propyl]acetamide
CID 104583126
2,2,2-trifluoro-N-[2-(1,3-thiazol-2-yl)propyl]acetamide
CID 104583148
4-amino-5-oxo-5-[2-(1,3-thiazol-2-yl)propylamino]pentanoic acid
CID 114127534
2-methyl-N-[(1R)-1-(1,3-thiazol-2-yl)ethyl]propanamide
CID 144903789
2-methyl-N-[1-(1,3-thiazol-2-yl)ethyl]propanamide
CID 63613076
2,2,3,3,3-pentafluoro-N-[2-(1,3-thiazol-2-yl)propyl]propanamide
CID 114129313
2-hydroxy-N-[2-(1,3-thiazol-2-yl)propyl]benzamide
CID 113428975
3,3-dimethyl-5-oxo-5-[2-(1,3-thiazol-2-yl)propylamino]pentanoic acid
CID 104576296
2-fluoro-N-[2-(1,3-thiazol-2-yl)propyl]benzamide
CID 113428973
3-hydroxy-2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide
CID 104583096
4-[2-(1,3-thiazol-2-yl)propylcarbamoyl]-1H-imidazole-5-carboxylic acid
CID 114127126

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide?
The IUPAC name of 2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide (CID 104578837) is 2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide.
What is the SMILES notation for 2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide?
The canonical SMILES for 2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide is CC(C)C(=O)NCC(C)c1nccs1.
What is the InChIKey of 2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide?
The InChIKey is QRATZIQKZFTNGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-7(2)9(13)12-6-8(3)10-11-4-5-14-10/h4-5,7-8H,6H2,1-3H3,(H,12,13).
What are the key properties of 2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide?
2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide has a molecular weight of 212.32 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide is sourced from PubChem (CID 104578837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).