1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone

C10H15N3OS — CID 115732052

IUPAC1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone
SMILESO=C(CNCc1cncs1)N1CCCC1
InChIInChI=1S/C10H15N3OS/c14-10(13-3-1-2-4-13)7-11-5-9-6-12-8-15-9/h6,8,11H,1-5,7H2
InChIKeyHEAPRPMPVGHHRX-UHFFFAOYSA-N
MW225.32 g/mol
LogP0.86
Rot. Bonds4

About 1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone

1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone (PubChem CID 115732052) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone.

Molecular Properties

Compound Name1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone
PubChem CID115732052
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone
SMILESO=C(CNCc1cncs1)N1CCCC1
InChIInChI=1S/C10H15N3OS/c14-10(13-3-1-2-4-13)7-11-5-9-6-12-8-15-9/h6,8,11H,1-5,7H2
InChIKeyHEAPRPMPVGHHRX-UHFFFAOYSA-N
XLogP0.86
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[methyl-[(2-methyl-1,3-thiazol-5-yl)methyl]amino]-N,N-dipropylacetamide
CID 52677539
2-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazole-5-carboxamide
CID 53537744
N-[(1,3-thiazol-5-yl)methyl]acetamide
CID 59473071
2,2,2-trifluoro-N-(1,3-thiazol-5-ylmethyl)acetamide
CID 104583481
2-[(2-methyl-1,3-thiazol-5-yl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide
CID 60958351
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78958377
N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78958410
N-(1,3-thiazol-5-ylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 104583569
2-(1,3-thiazol-5-ylmethylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 115732102
2-(1,3-thiazol-5-ylmethylamino)-N-(2,2,2-trifluoroethyl)propanamide
CID 115732133
2-amino-3,3,3-trifluoro-2-methyl-N-(1,3-thiazol-5-ylmethyl)propanamide
CID 116385327
4,4-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidine-2-carboxamide
CID 120351714

Frequently Asked Questions

What is the IUPAC name of 1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone?
The IUPAC name of 1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone (CID 115732052) is 1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone.
What is the SMILES notation for 1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone?
The canonical SMILES for 1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone is O=C(CNCc1cncs1)N1CCCC1.
What is the InChIKey of 1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone?
The InChIKey is HEAPRPMPVGHHRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c14-10(13-3-1-2-4-13)7-11-5-9-6-12-8-15-9/h6,8,11H,1-5,7H2.
What are the key properties of 1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone?
1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone has a molecular weight of 225.32 g/mol, XLogP of 0.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrrolidin-1-yl-2-(1,3-thiazol-5-ylmethylamino)ethanone is sourced from PubChem (CID 115732052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).