2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol

C10H18N2OS — CID 62961013

IUPAC2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol
SMILESCCCN(CCO)c1nc(CC)cs1
InChIInChI=1S/C10H18N2OS/c1-3-5-12(6-7-13)10-11-9(4-2)8-14-10/h8,13H,3-7H2,1-2H3
InChIKeyNNLKRDGEJBCUHJ-UHFFFAOYSA-N
MW214.33 g/mol
LogP1.91
Rot. Bonds6

About 2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol

2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol (PubChem CID 62961013) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is 2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol.

Molecular Properties

Compound Name2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol
PubChem CID62961013
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC Name2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol
SMILESCCCN(CCO)c1nc(CC)cs1
InChIInChI=1S/C10H18N2OS/c1-3-5-12(6-7-13)10-11-9(4-2)8-14-10/h8,13H,3-7H2,1-2H3
InChIKeyNNLKRDGEJBCUHJ-UHFFFAOYSA-N
XLogP1.91
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 64543594
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CID 64544605
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CID 64544805
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CID 64544807
CID 64544807

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol?
The IUPAC name of 2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol (CID 62961013) is 2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol.
What is the SMILES notation for 2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol?
The canonical SMILES for 2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol is CCCN(CCO)c1nc(CC)cs1.
What is the InChIKey of 2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol?
The InChIKey is NNLKRDGEJBCUHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2OS/c1-3-5-12(6-7-13)10-11-9(4-2)8-14-10/h8,13H,3-7H2,1-2H3.
What are the key properties of 2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol?
2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol has a molecular weight of 214.33 g/mol, XLogP of 1.91, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethyl-1,3-thiazol-2-yl)-propylamino]ethanol is sourced from PubChem (CID 62961013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).