2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide

C14H23N3O2S — CID 75483316

IUPAC2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide
SMILESCN(C1CCCC1)C(C)(C)C(=O)NCc1csc(=O)[nH]1
InChIInChI=1S/C14H23N3O2S/c1-14(2,17(3)11-6-4-5-7-11)12(18)15-8-10-9-20-13(19)16-10/h9,11H,4-8H2,1-3H3,(H,15,18)(H,16,19)
InChIKeyXAQWWJFIJOPFBB-UHFFFAOYSA-N
MW297.42 g/mol
LogP1.71
Rot. Bonds5

About 2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide

2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide (PubChem CID 75483316) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is 2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide.

Molecular Properties

Compound Name2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide
PubChem CID75483316
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC Name2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide
SMILESCN(C1CCCC1)C(C)(C)C(=O)NCc1csc(=O)[nH]1
InChIInChI=1S/C14H23N3O2S/c1-14(2,17(3)11-6-4-5-7-11)12(18)15-8-10-9-20-13(19)16-10/h9,11H,4-8H2,1-3H3,(H,15,18)(H,16,19)
InChIKeyXAQWWJFIJOPFBB-UHFFFAOYSA-N
XLogP1.71
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide?
The IUPAC name of 2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide (CID 75483316) is 2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide.
What is the SMILES notation for 2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide?
The canonical SMILES for 2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide is CN(C1CCCC1)C(C)(C)C(=O)NCc1csc(=O)[nH]1.
What is the InChIKey of 2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide?
The InChIKey is XAQWWJFIJOPFBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-14(2,17(3)11-6-4-5-7-11)12(18)15-8-10-9-20-13(19)16-10/h9,11H,4-8H2,1-3H3,(H,15,18)(H,16,19).
What are the key properties of 2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide?
2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide has a molecular weight of 297.42 g/mol, XLogP of 1.71, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide is sourced from PubChem (CID 75483316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).