4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride

C11H18ClN3O2S — CID 120589106

IUPAC4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride
SMILESCOC(CN)CC(=O)Nc1nc(C2CC2)cs1.Cl
InChIInChI=1S/C11H17N3O2S.ClH/c1-16-8(5-12)4-10(15)14-11-13-9(6-17-11)7-2-3-7;/h6-8H,2-5,12H2,1H3,(H,13,14,15);1H
InChIKeyBMPIUKUDNVSESN-UHFFFAOYSA-N
MW291.80 g/mol
LogP1.74
Rot. Bonds6

About 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride

4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride (PubChem CID 120589106) has the molecular formula C11H18ClN3O2S and a molecular weight of 291.80 g/mol. Its IUPAC name is 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride.

Molecular Properties

Compound Name4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride
PubChem CID120589106
Molecular FormulaC11H18ClN3O2S
Molecular Weight291.80 g/mol
Exact Mass291.08
IUPAC Name4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride
SMILESCOC(CN)CC(=O)Nc1nc(C2CC2)cs1.Cl
InChIInChI=1S/C11H17N3O2S.ClH/c1-16-8(5-12)4-10(15)14-11-13-9(6-17-11)7-2-3-7;/h6-8H,2-5,12H2,1H3,(H,13,14,15);1H
InChIKeyBMPIUKUDNVSESN-UHFFFAOYSA-N
XLogP1.74
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.80
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride 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

4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide
CID 103155653
3-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-methoxypropanamide
CID 106112621
ethyl 2-[2-[(4-amino-3-methoxybutanoyl)amino]-1,3-thiazol-4-yl]acetate;hydrochloride
CID 120586454
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-(propan-2-ylamino)acetamide
CID 61482373
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-(4-methoxyphenyl)acetamide
CID 32865071
3-amino-4-[(4-cyclopropyl-1,3-thiazol-2-yl)amino]-4-oxobutanoic acid
CID 64894586
2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-methylpropanamide;hydrochloride
CID 119292978
N-(4-cyclohexyl-1,3-thiazol-2-yl)propanamide
CID 5141035
2-(tert-butylamino)-N-(4-cyclopropyl-1,3-thiazol-2-yl)acetamide
CID 47842528
2-cyclopentyloxy-N-(4-cyclopropyl-1,3-thiazol-2-yl)acetamide
CID 47243063
N-(4-cyclopropyl-1,3-thiazol-2-yl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120623224
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-(3,4-dimethoxyphenyl)acetamide
CID 32865339

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride?
The IUPAC name of 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride (CID 120589106) is 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride.
What is the SMILES notation for 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride?
The canonical SMILES for 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride is COC(CN)CC(=O)Nc1nc(C2CC2)cs1.Cl.
What is the InChIKey of 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride?
The InChIKey is BMPIUKUDNVSESN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2S.ClH/c1-16-8(5-12)4-10(15)14-11-13-9(6-17-11)7-2-3-7;/h6-8H,2-5,12H2,1H3,(H,13,14,15);1H.
What are the key properties of 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride?
4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride has a molecular weight of 291.80 g/mol, XLogP of 1.74, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methoxybutanamide;hydrochloride is sourced from PubChem (CID 120589106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).