N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide

C16H24N2O3S — CID 47082562

IUPACN-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide
SMILESCC(C)C(OCC1CCCO1)C(=O)Nc1nc(C2CC2)cs1
InChIInChI=1S/C16H24N2O3S/c1-10(2)14(21-8-12-4-3-7-20-12)15(19)18-16-17-13(9-22-16)11-5-6-11/h9-12,14H,3-8H2,1-2H3,(H,17,18,19)
InChIKeyYDDJIQIOABZHED-UHFFFAOYSA-N
MW324.45 g/mol
LogP3.18
Rot. Bonds7

About N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide

N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide (PubChem CID 47082562) has the molecular formula C16H24N2O3S and a molecular weight of 324.45 g/mol. Its IUPAC name is N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide.

Molecular Properties

Compound NameN-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide
PubChem CID47082562
Molecular FormulaC16H24N2O3S
Molecular Weight324.45 g/mol
Exact Mass324.15
IUPAC NameN-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide
SMILESCC(C)C(OCC1CCCO1)C(=O)Nc1nc(C2CC2)cs1
InChIInChI=1S/C16H24N2O3S/c1-10(2)14(21-8-12-4-3-7-20-12)15(19)18-16-17-13(9-22-16)11-5-6-11/h9-12,14H,3-8H2,1-2H3,(H,17,18,19)
InChIKeyYDDJIQIOABZHED-UHFFFAOYSA-N
XLogP3.18
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide 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

(2R)-N-(4-amino-3,5-dichlorophenyl)-3-methyl-2-[[(2R)-oxolan-2-yl]methoxy]butanamide
CID 52536429
(2S)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-[[(2R)-oxan-2-yl]methoxy]propanamide
CID 94814555
(2S)-2-acetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)propanamide
CID 32864950
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-(propan-2-ylamino)acetamide
CID 61482373
(2S)-N-[(1S)-1-(3,4-difluorophenyl)ethyl]-3-methyl-2-[[(2S)-oxolan-2-yl]methoxy]butanamide
CID 52539512
3-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-methoxypropanamide
CID 106112621
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-(4-fluorophenoxy)propanamide
CID 46593861
N-(4-cyclopropyl-1,3-thiazol-2-yl)morpholine-4-carboxamide
CID 47200518
3-amino-4-[(4-cyclopropyl-1,3-thiazol-2-yl)amino]-4-oxobutanoic acid
CID 64894586
(2R)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-[[(2S)-oxolan-2-yl]methoxy]propanamide
CID 94795987
(2S)-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]-3-methyl-2-[[(2R)-oxolan-2-yl]methoxy]butanehydrazide
CID 95341337
(2R)-2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pentanamide
CID 103795479

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide?
The IUPAC name of N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide (CID 47082562) is N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide.
What is the SMILES notation for N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide?
The canonical SMILES for N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide is CC(C)C(OCC1CCCO1)C(=O)Nc1nc(C2CC2)cs1.
What is the InChIKey of N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide?
The InChIKey is YDDJIQIOABZHED-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3S/c1-10(2)14(21-8-12-4-3-7-20-12)15(19)18-16-17-13(9-22-16)11-5-6-11/h9-12,14H,3-8H2,1-2H3,(H,17,18,19).
What are the key properties of N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide?
N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide has a molecular weight of 324.45 g/mol, XLogP of 3.18, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methyl-2-(oxolan-2-ylmethoxy)butanamide is sourced from PubChem (CID 47082562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).