[2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol

C11H21N3OS — CID 62754062

IUPAC[2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol
SMILESCCCN(CCN(C)C)c1ncc(CO)s1
InChIInChI=1S/C11H21N3OS/c1-4-5-14(7-6-13(2)3)11-12-8-10(9-15)16-11/h8,15H,4-7,9H2,1-3H3
InChIKeyXGELEQOJGXPTID-UHFFFAOYSA-N
MW243.38 g/mol
LogP1.41
Rot. Bonds7

About [2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol

[2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol (PubChem CID 62754062) has the molecular formula C11H21N3OS and a molecular weight of 243.38 g/mol. Its IUPAC name is [2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol
PubChem CID62754062
Molecular FormulaC11H21N3OS
Molecular Weight243.38 g/mol
Exact Mass243.14
IUPAC Name[2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol
SMILESCCCN(CCN(C)C)c1ncc(CO)s1
InChIInChI=1S/C11H21N3OS/c1-4-5-14(7-6-13(2)3)11-12-8-10(9-15)16-11/h8,15H,4-7,9H2,1-3H3
InChIKeyXGELEQOJGXPTID-UHFFFAOYSA-N
XLogP1.41
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.38
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[5-[2-(dimethylamino)ethyl-propylamino]pyrazin-2-yl]methanol
CID 107372809
[2-[ethyl(2-methylbutyl)amino]-1,3-thiazol-5-yl]methanol
CID 79481173
N,N-dimethyl-N'-(2-methylpropyl)-N'-[5-[(propan-2-ylamino)methyl]-1,3-thiazol-2-yl]ethane-1,2-diamine
CID 62753392
[2-[methyl(1-methylsulfanylpropan-2-yl)amino]-1,3-thiazol-5-yl]methanol
CID 112666401
[2-[pentyl(propan-2-yl)amino]-1,3-thiazol-5-yl]methanol
CID 62754215
[4-cyclopropyl-2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol
CID 63917040
[2-(N,3,5-trimethylanilino)-1,3-thiazol-5-yl]methanol
CID 55111939
[5-bromo-2-[2-(dimethylamino)ethyl-propylamino]-3-pyridinyl]methanol
CID 62001126
[2-[methyl(2-thiophen-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol
CID 79494341
[2-[methyl(oxan-4-yl)amino]-1,3-thiazol-5-yl]methanol
CID 62752479
[2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol
CID 62752453
5-(aminomethyl)-N,N-diethyl-1,3-thiazol-2-amine
CID 18801628

Frequently Asked Questions

What is the IUPAC name of [2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol (CID 62754062) is [2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol is CCCN(CCN(C)C)c1ncc(CO)s1.
What is the InChIKey of [2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol?
The InChIKey is XGELEQOJGXPTID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3OS/c1-4-5-14(7-6-13(2)3)11-12-8-10(9-15)16-11/h8,15H,4-7,9H2,1-3H3.
What are the key properties of [2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol?
[2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol has a molecular weight of 243.38 g/mol, XLogP of 1.41, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 62754062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).