2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one

C10H14N2OS — CID 130757840

IUPAC2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one
SMILESCc1nc(C(=O)C(C)(N)C2CC2)cs1
InChIInChI=1S/C10H14N2OS/c1-6-12-8(5-14-6)9(13)10(2,11)7-3-4-7/h5,7H,3-4,11H2,1-2H3
InChIKeyUHZNBNGBGMECIP-UHFFFAOYSA-N
MW210.30 g/mol
LogP1.76
Rot. Bonds3

About 2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one

2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one (PubChem CID 130757840) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one
PubChem CID130757840
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC Name2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one
SMILESCc1nc(C(=O)C(C)(N)C2CC2)cs1
InChIInChI=1S/C10H14N2OS/c1-6-12-8(5-14-6)9(13)10(2,11)7-3-4-7/h5,7H,3-4,11H2,1-2H3
InChIKeyUHZNBNGBGMECIP-UHFFFAOYSA-N
XLogP1.76
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-difluoro-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one
CID 131182360
N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-1,3-thiazole-4-carboxamide
CID 81485764
2-amino-2-cyclopropyl-1-(5-methylthiophen-3-yl)propan-1-one
CID 116558651
2-amino-2-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 60867878
(2-aminocyclopentyl)-(2-methyl-1,3-thiazol-4-yl)methanone
CID 127004310
(4-aminopiperidin-1-yl)-(2-methyl-1,3-thiazol-4-yl)methanone
CID 65199009
2-cyclopropyl-2-hydroxy-1-(2-methyl-1,3-thiazol-4-yl)ethanone
CID 131204307
2-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazole-4-carboxamide
CID 110465347
[4-(2-aminoethyl)piperidin-1-yl]-(2-methyl-1,3-thiazol-4-yl)methanone
CID 65199184
(3-methylcyclopentyl)-(2-methyl-1,3-thiazol-4-yl)methanone
CID 130815632
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-methyl-1,3-thiazole-4-carboxamide
CID 103933370
methyl 2-methyl-1,3-thiazole-4-carboxylate
CID 14812829

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one?
The IUPAC name of 2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one (CID 130757840) is 2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one.
What is the SMILES notation for 2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one?
The canonical SMILES for 2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one is Cc1nc(C(=O)C(C)(N)C2CC2)cs1.
What is the InChIKey of 2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one?
The InChIKey is UHZNBNGBGMECIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2OS/c1-6-12-8(5-14-6)9(13)10(2,11)7-3-4-7/h5,7H,3-4,11H2,1-2H3.
What are the key properties of 2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one?
2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one has a molecular weight of 210.30 g/mol, XLogP of 1.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-one is sourced from PubChem (CID 130757840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).