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

C9H15N3OS — CID 83624959

IUPAC2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide
SMILESCc1nc(C)c(CNC(=O)C(C)N)s1
InChIInChI=1S/C9H15N3OS/c1-5(10)9(13)11-4-8-6(2)12-7(3)14-8/h5H,4,10H2,1-3H3,(H,11,13)
InChIKeyFWQZRTQQHWSNMT-UHFFFAOYSA-N
MW213.31 g/mol
LogP0.72
Rot. Bonds3

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

2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide (PubChem CID 83624959) has the molecular formula C9H15N3OS and a molecular weight of 213.31 g/mol. Its IUPAC name is 2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide.

Molecular Properties

Compound Name2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide
PubChem CID83624959
Molecular FormulaC9H15N3OS
Molecular Weight213.31 g/mol
Exact Mass213.09
IUPAC Name2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide
SMILESCc1nc(C)c(CNC(=O)C(C)N)s1
InChIInChI=1S/C9H15N3OS/c1-5(10)9(13)11-4-8-6(2)12-7(3)14-8/h5H,4,10H2,1-3H3,(H,11,13)
InChIKeyFWQZRTQQHWSNMT-UHFFFAOYSA-N
XLogP0.72
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.31
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]butanamide
CID 119891888
(2S)-2-amino-N-[(4-methyl-2-phenyl-1,3-thiazol-5-yl)methyl]propanamide
CID 119316963
2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-3-phenylpropanamide;dihydrochloride
CID 119891833
2-(3,5-dimethylphenoxy)-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide
CID 121122639
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]prop-2-enamide
CID 131129143
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-(2-methoxy-4-methylphenoxy)propanamide
CID 121122663
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-(2-methylphenyl)acetamide
CID 121122681
1-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclohexane-1-carboxamide
CID 119891897
2-(3-chlorophenoxy)-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide
CID 121122668
1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-3-[2-(2-hydroxyethyl)-4-methylpentyl]urea
CID 111507954
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide
CID 121122773
1-acetyl-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide
CID 121122731

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide?
The IUPAC name of 2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide (CID 83624959) is 2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide.
What is the SMILES notation for 2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide?
The canonical SMILES for 2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide is Cc1nc(C)c(CNC(=O)C(C)N)s1.
What is the InChIKey of 2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide?
The InChIKey is FWQZRTQQHWSNMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3OS/c1-5(10)9(13)11-4-8-6(2)12-7(3)14-8/h5H,4,10H2,1-3H3,(H,11,13).
What are the key properties of 2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide?
2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide has a molecular weight of 213.31 g/mol, XLogP of 0.72, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]propanamide is sourced from PubChem (CID 83624959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).