2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide

C10H16N2OS — CID 63373273

IUPAC2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide
SMILESCc1ncsc1CNC(=O)C(C)(C)C
InChIInChI=1S/C10H16N2OS/c1-7-8(14-6-12-7)5-11-9(13)10(2,3)4/h6H,5H2,1-4H3,(H,11,13)
InChIKeyVVBFKRFMSQPTHK-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.11
Rot. Bonds2

About 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide

2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide (PubChem CID 63373273) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide
PubChem CID63373273
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide
SMILESCc1ncsc1CNC(=O)C(C)(C)C
InChIInChI=1S/C10H16N2OS/c1-7-8(14-6-12-7)5-11-9(13)10(2,3)4/h6H,5H2,1-4H3,(H,11,13)
InChIKeyVVBFKRFMSQPTHK-UHFFFAOYSA-N
XLogP2.11
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyano-2-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide
CID 63284243
N-[(4-methyl-1,3-thiazol-5-yl)methyl]prop-2-ynamide
CID 131203570
N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide
CID 63373165
2-bromo-N-[(4-methyl-1,3-thiazol-5-yl)methyl]acetamide
CID 63681267
(2R)-2-hydroxy-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide
CID 130609015
4-[(4-methyl-1,3-thiazol-5-yl)methylamino]-4-oxobutanoic acid
CID 63280743
1-[(4-methyl-1,3-thiazol-5-yl)methyl]-3-propylurea
CID 115612251
2-methyl-3-[(4-methyl-1,3-thiazol-5-yl)methylamino]-3-oxopropanoic acid
CID 114898424
4-methyl-4-[(4-methyl-1,3-thiazol-5-yl)methylcarbamoylamino]pentanoic acid
CID 63284168
2-anilino-N-[(4-methyl-1,3-thiazol-5-yl)methyl]acetamide
CID 63281191
3-methyl-3-[(4-methyl-1,3-thiazol-5-yl)methylamino]butanamide
CID 106096010
2,2-dimethyl-N-[(3-methylthiophen-2-yl)methyl]propanamide
CID 112725782

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide (CID 63373273) is 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide is Cc1ncsc1CNC(=O)C(C)(C)C.
What is the InChIKey of 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide?
The InChIKey is VVBFKRFMSQPTHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-7-8(14-6-12-7)5-11-9(13)10(2,3)4/h6H,5H2,1-4H3,(H,11,13).
What are the key properties of 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide?
2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide has a molecular weight of 212.32 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide is sourced from PubChem (CID 63373273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).