propan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate

C10H16N2O2S — CID 116654722

IUPACpropan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate
SMILESCCc1nc(NC(=O)OC(C)C)sc1C
InChIInChI=1S/C10H16N2O2S/c1-5-8-7(4)15-9(11-8)12-10(13)14-6(2)3/h6H,5H2,1-4H3,(H,11,12,13)
InChIKeySHCRUNQPYDVUHY-UHFFFAOYSA-N
MW228.32 g/mol
LogP2.97
Rot. Bonds3

About propan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate

propan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate (PubChem CID 116654722) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is propan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate.

Molecular Properties

Compound Namepropan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate
PubChem CID116654722
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC Namepropan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate
SMILESCCc1nc(NC(=O)OC(C)C)sc1C
InChIInChI=1S/C10H16N2O2S/c1-5-8-7(4)15-9(11-8)12-10(13)14-6(2)3/h6H,5H2,1-4H3,(H,11,12,13)
InChIKeySHCRUNQPYDVUHY-UHFFFAOYSA-N
XLogP2.97
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-ethyl-5-methyl-1,3-thiazol-2-yl)amino]-2,3-dimethyl-4-oxobut-2-enoic acid
CID 76992577
3-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride
CID 119735313
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide
CID 104936659
2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-methylpropanamide;hydrochloride
CID 119295888
(2S)-2-[(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamoylamino]-4-methylpentanoic acid
CID 61475554
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(1-hydroxycyclopentyl)acetamide
CID 111430638
2,6-dichloro-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 60786100
2-amino-N-[2-[(4-ethyl-5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]acetamide
CID 54953528
(2R)-2-[(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamoylamino]-3,3-dimethylbutanoic acid
CID 103927766
4-amino-5-[(4-ethyl-5-methyl-1,3-thiazol-2-yl)amino]-5-oxopentanoic acid
CID 64888760
(2R)-2-[(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamoylamino]pentanoic acid
CID 107566477
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-methyl-1,3-thiazole-4-carboxamide
CID 47444190

Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate?
The IUPAC name of propan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate (CID 116654722) is propan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate.
What is the SMILES notation for propan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate?
The canonical SMILES for propan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate is CCc1nc(NC(=O)OC(C)C)sc1C.
What is the InChIKey of propan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate?
The InChIKey is SHCRUNQPYDVUHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-5-8-7(4)15-9(11-8)12-10(13)14-6(2)3/h6H,5H2,1-4H3,(H,11,12,13).
What are the key properties of propan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate?
propan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate has a molecular weight of 228.32 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)carbamate is sourced from PubChem (CID 116654722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).