1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol

C8H15N3OS — CID 103359829

IUPAC1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol
SMILESCc1c(N)nsc1NCC(C)(C)O
InChIInChI=1S/C8H15N3OS/c1-5-6(9)11-13-7(5)10-4-8(2,3)12/h10,12H,4H2,1-3H3,(H2,9,11)
InChIKeyBNOUDISLIAMFGO-UHFFFAOYSA-N
MW201.29 g/mol
LogP1.22
Rot. Bonds3

About 1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol

1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol (PubChem CID 103359829) has the molecular formula C8H15N3OS and a molecular weight of 201.29 g/mol. Its IUPAC name is 1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol
PubChem CID103359829
Molecular FormulaC8H15N3OS
Molecular Weight201.29 g/mol
Exact Mass201.09
IUPAC Name1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol
SMILESCc1c(N)nsc1NCC(C)(C)O
InChIInChI=1S/C8H15N3OS/c1-5-6(9)11-13-7(5)10-4-8(2,3)12/h10,12H,4H2,1-3H3,(H2,9,11)
InChIKeyBNOUDISLIAMFGO-UHFFFAOYSA-N
XLogP1.22
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.29
LogP ≤ 51.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-5-N-[(4-methylphenyl)methyl]-1,2-thiazole-3,5-diamine
CID 103363729
4-methyl-5-N-[[4-(trifluoromethyl)phenyl]methyl]-1,2-thiazole-3,5-diamine
CID 103361077
5-[(2-hydroxy-2-methylpropyl)amino]-3-methyl-1,2-thiazole-4-carbonitrile
CID 130964806
5-N-benzyl-4-methyl-1,2-thiazole-3,5-diamine
CID 103363458
5-N-(3-methoxypropyl)-4-methyl-1,2-thiazole-3,5-diamine
CID 103363859
5-N-(cyclohexylmethyl)-4-methyl-1,2-thiazole-3,5-diamine
CID 103363934
3-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-propylpropanamide
CID 103360319
5-(2,2-dimethylhydrazinyl)-4-methyl-1,2-thiazol-3-amine
CID 103364838
4-methyl-5-N-(2-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine
CID 103364171
4-methyl-5-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1,2-thiazole-3,5-diamine
CID 103359286
4-methyl-5-N-(thiophen-3-ylmethyl)-1,2-thiazole-3,5-diamine
CID 103361186
4-methyl-5-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-1,2-thiazole-3,5-diamine
CID 103359201

Frequently Asked Questions

What is the IUPAC name of 1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol?
The IUPAC name of 1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol (CID 103359829) is 1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol is Cc1c(N)nsc1NCC(C)(C)O.
What is the InChIKey of 1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol?
The InChIKey is BNOUDISLIAMFGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3OS/c1-5-6(9)11-13-7(5)10-4-8(2,3)12/h10,12H,4H2,1-3H3,(H2,9,11).
What are the key properties of 1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol?
1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol has a molecular weight of 201.29 g/mol, XLogP of 1.22, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-2-methylpropan-2-ol is sourced from PubChem (CID 103359829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).