4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide

C12H19N3O2S — CID 112703598

IUPAC4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide
SMILESCOC1CNC(C(=O)NC(C)c2ncc(C)s2)C1
InChIInChI=1S/C12H19N3O2S/c1-7-5-14-12(18-7)8(2)15-11(16)10-4-9(17-3)6-13-10/h5,8-10,13H,4,6H2,1-3H3,(H,15,16)
InChIKeyOVJPDGJWPVIONJ-UHFFFAOYSA-N
MW269.37 g/mol
LogP1.01
Rot. Bonds4

About 4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide

4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide (PubChem CID 112703598) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is 4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide
PubChem CID112703598
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC Name4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide
SMILESCOC1CNC(C(=O)NC(C)c2ncc(C)s2)C1
InChIInChI=1S/C12H19N3O2S/c1-7-5-14-12(18-7)8(2)15-11(16)10-4-9(17-3)6-13-10/h5,8-10,13H,4,6H2,1-3H3,(H,15,16)
InChIKeyOVJPDGJWPVIONJ-UHFFFAOYSA-N
XLogP1.01
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide 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

N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-4-methoxypyrrolidine-2-carboxamide
CID 61214522
4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide
CID 61214153
4-methoxy-N-[1-(2-methylphenyl)ethyl]pyrrolidine-2-carboxamide
CID 61260072
4-methoxy-N-propan-2-ylpyrrolidine-2-carboxamide
CID 61213428
N-(1-cyclopropylethyl)-4-methoxypyrrolidine-2-carboxamide
CID 61213308
N-[1-(furan-2-yl)ethyl]-4-methoxypyrrolidine-2-carboxamide
CID 61213451
3-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclobutan-1-amine
CID 104871887
N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide
CID 81366720
4-methoxy-N-[(1R)-1-(3-methoxyphenyl)ethyl]pyrrolidine-2-carboxamide
CID 81373074
3-[(4-methoxypyrrolidine-2-carbonyl)amino]-2-methylbutanoic acid
CID 113416438
2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclohexane-1-carboxamide
CID 112702025
2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide
CID 112702007

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide?
The IUPAC name of 4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide (CID 112703598) is 4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide is COC1CNC(C(=O)NC(C)c2ncc(C)s2)C1.
What is the InChIKey of 4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide?
The InChIKey is OVJPDGJWPVIONJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-7-5-14-12(18-7)8(2)15-11(16)10-4-9(17-3)6-13-10/h5,8-10,13H,4,6H2,1-3H3,(H,15,16).
What are the key properties of 4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide?
4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide has a molecular weight of 269.37 g/mol, XLogP of 1.01, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 112703598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).