1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol

C11H21N3OS — CID 103837763

IUPAC1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol
SMILESCCc1csc(NCC(C)(O)CN(C)C)n1
InChIInChI=1S/C11H21N3OS/c1-5-9-6-16-10(13-9)12-7-11(2,15)8-14(3)4/h6,15H,5,7-8H2,1-4H3,(H,12,13)
InChIKeyHGMUZEFUFXFBBD-UHFFFAOYSA-N
MW243.38 g/mol
LogP1.43
Rot. Bonds6

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

1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol (PubChem CID 103837763) has the molecular formula C11H21N3OS and a molecular weight of 243.38 g/mol. Its IUPAC name is 1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol
PubChem CID103837763
Molecular FormulaC11H21N3OS
Molecular Weight243.38 g/mol
Exact Mass243.14
IUPAC Name1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol
SMILESCCc1csc(NCC(C)(O)CN(C)C)n1
InChIInChI=1S/C11H21N3OS/c1-5-9-6-16-10(13-9)12-7-11(2,15)8-14(3)4/h6,15H,5,7-8H2,1-4H3,(H,12,13)
InChIKeyHGMUZEFUFXFBBD-UHFFFAOYSA-N
XLogP1.43
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.38
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[[4-(2-chlorophenyl)-1,3-thiazol-2-yl]amino]-3-(dimethylamino)-2-methylpropan-2-ol
CID 133451634
1-[(3-amino-1,2,4-thiadiazol-5-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol
CID 106149684
N-(4-ethyl-1,3-thiazol-2-yl)-2,2-dimethylpentane-1,5-diamine
CID 106143003
2-[(4-ethyl-1,3-thiazol-2-yl)amino]acetic acid
CID 62960794
4-[(4-ethyl-1,3-thiazol-2-yl)amino]butan-1-ol
CID 106842633
6-[(4-ethyl-1,3-thiazol-2-yl)amino]hexan-1-ol
CID 103918134
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]acetamide
CID 103839734
2-N-(4-ethyl-1,3-thiazol-2-yl)-1-N,1-N,4-trimethylpentane-1,2-diamine
CID 62961188
4-[(4-ethyl-1,3-thiazol-2-yl)amino]-4-methylpentanoic acid
CID 62963353
1-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol
CID 106149395
N',N'-diethyl-N-(4-ethyl-1,3-thiazol-2-yl)propane-1,3-diamine
CID 62963177
1-(dimethylamino)-2-methyl-3-[(5-nitro-1,3-thiazol-2-yl)amino]propan-2-ol
CID 114149789

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol?
The IUPAC name of 1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol (CID 103837763) is 1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol?
The canonical SMILES for 1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol is CCc1csc(NCC(C)(O)CN(C)C)n1.
What is the InChIKey of 1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol?
The InChIKey is HGMUZEFUFXFBBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3OS/c1-5-9-6-16-10(13-9)12-7-11(2,15)8-14(3)4/h6,15H,5,7-8H2,1-4H3,(H,12,13).
What are the key properties of 1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol?
1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol has a molecular weight of 243.38 g/mol, XLogP of 1.43, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylamino)-3-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-2-ol is sourced from PubChem (CID 103837763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).