2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide

C10H15N3O2S — CID 106381315

IUPAC2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide
SMILESO=C(CNCC1CC1)NCc1csc(=O)[nH]1
InChIInChI=1S/C10H15N3O2S/c14-9(5-11-3-7-1-2-7)12-4-8-6-16-10(15)13-8/h6-7,11H,1-5H2,(H,12,14)(H,13,15)
InChIKeyZCGAPSOQCZYMQZ-UHFFFAOYSA-N
MW241.32 g/mol
LogP0.05
Rot. Bonds6

About 2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide

2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide (PubChem CID 106381315) has the molecular formula C10H15N3O2S and a molecular weight of 241.32 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide
PubChem CID106381315
Molecular FormulaC10H15N3O2S
Molecular Weight241.32 g/mol
Exact Mass241.09
IUPAC Name2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide
SMILESO=C(CNCC1CC1)NCc1csc(=O)[nH]1
InChIInChI=1S/C10H15N3O2S/c14-9(5-11-3-7-1-2-7)12-4-8-6-16-10(15)13-8/h6-7,11H,1-5H2,(H,12,14)(H,13,15)
InChIKeyZCGAPSOQCZYMQZ-UHFFFAOYSA-N
XLogP0.05
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 50.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide (CID 106381315) is 2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide is O=C(CNCC1CC1)NCc1csc(=O)[nH]1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide?
The InChIKey is ZCGAPSOQCZYMQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2S/c14-9(5-11-3-7-1-2-7)12-4-8-6-16-10(15)13-8/h6-7,11H,1-5H2,(H,12,14)(H,13,15).
What are the key properties of 2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide?
2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide has a molecular weight of 241.32 g/mol, XLogP of 0.05, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide is sourced from PubChem (CID 106381315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).