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

C10H18N2OS — CID 115691889

IUPAC3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol
SMILESCCc1csc(NC(CC)CCO)n1
InChIInChI=1S/C10H18N2OS/c1-3-8(5-6-13)11-10-12-9(4-2)7-14-10/h7-8,13H,3-6H2,1-2H3,(H,11,12)
InChIKeyKIXJMRPNBZUUSD-UHFFFAOYSA-N
MW214.33 g/mol
LogP2.28
Rot. Bonds6

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

3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol (PubChem CID 115691889) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is 3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol.

Molecular Properties

Compound Name3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol
PubChem CID115691889
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC Name3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol
SMILESCCc1csc(NC(CC)CCO)n1
InChIInChI=1S/C10H18N2OS/c1-3-8(5-6-13)11-10-12-9(4-2)7-14-10/h7-8,13H,3-6H2,1-2H3,(H,11,12)
InChIKeyKIXJMRPNBZUUSD-UHFFFAOYSA-N
XLogP2.28
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(4-ethyl-1,3-thiazol-2-yl)hexane-1,2-diamine
CID 80704374
N-but-3-en-2-yl-4-ethyl-1,3-thiazol-2-amine
CID 115691974
3-[(4-ethyl-1,3-thiazol-2-yl)amino]butanoic acid
CID 62963347
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]butan-1-ol
CID 106842633
3-[(4-chloro-1,3-thiazol-2-yl)amino]-4-methoxybutan-1-ol
CID 106157701
N-(1-chloro-3-phenylpropan-2-yl)-4-ethyl-1,3-thiazol-2-amine
CID 65029172
2-N-(4-ethyl-1,3-thiazol-2-yl)-3-phenylpropane-1,2-diamine
CID 55242376
N-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine
CID 58745672
2-(1-hydroxybutan-2-ylamino)-1,3-thiazole-4-carboxylic acid
CID 84761744
2-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]butan-1-ol
CID 133365985
6-[(4-ethyl-1,3-thiazol-2-yl)amino]hexan-1-ol
CID 103918134

Frequently Asked Questions

What is the IUPAC name of 3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol?
The IUPAC name of 3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol (CID 115691889) is 3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol.
What is the SMILES notation for 3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol?
The canonical SMILES for 3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol is CCc1csc(NC(CC)CCO)n1.
What is the InChIKey of 3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol?
The InChIKey is KIXJMRPNBZUUSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2OS/c1-3-8(5-6-13)11-10-12-9(4-2)7-14-10/h7-8,13H,3-6H2,1-2H3,(H,11,12).
What are the key properties of 3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol?
3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol has a molecular weight of 214.33 g/mol, XLogP of 2.28, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol is sourced from PubChem (CID 115691889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).