4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride

C10H18ClN3OS — CID 119295908

IUPAC4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride
SMILESCCc1nc(NC(=O)CCCN)sc1C.Cl
InChIInChI=1S/C10H17N3OS.ClH/c1-3-8-7(2)15-10(12-8)13-9(14)5-4-6-11;/h3-6,11H2,1-2H3,(H,12,13,14);1H
InChIKeyQKOSRGXQTFGRMS-UHFFFAOYSA-N
MW263.79 g/mol
LogP2.11
Rot. Bonds5

About 4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride

4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride (PubChem CID 119295908) has the molecular formula C10H18ClN3OS and a molecular weight of 263.79 g/mol. Its IUPAC name is 4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride.

Molecular Properties

Compound Name4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride
PubChem CID119295908
Molecular FormulaC10H18ClN3OS
Molecular Weight263.79 g/mol
Exact Mass263.09
IUPAC Name4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride
SMILESCCc1nc(NC(=O)CCCN)sc1C.Cl
InChIInChI=1S/C10H17N3OS.ClH/c1-3-8-7(2)15-10(12-8)13-9(14)5-4-6-11;/h3-6,11H2,1-2H3,(H,12,13,14);1H
InChIKeyQKOSRGXQTFGRMS-UHFFFAOYSA-N
XLogP2.11
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.79
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride?
The IUPAC name of 4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride (CID 119295908) is 4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride.
What is the SMILES notation for 4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride?
The canonical SMILES for 4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride is CCc1nc(NC(=O)CCCN)sc1C.Cl.
What is the InChIKey of 4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride?
The InChIKey is QKOSRGXQTFGRMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3OS.ClH/c1-3-8-7(2)15-10(12-8)13-9(14)5-4-6-11;/h3-6,11H2,1-2H3,(H,12,13,14);1H.
What are the key properties of 4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride?
4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride has a molecular weight of 263.79 g/mol, XLogP of 2.11, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)butanamide;hydrochloride is sourced from PubChem (CID 119295908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).