3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine

C13H17N3OS — CID 114127933

IUPAC3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine
SMILESCCOc1cccnc1NCC(C)c1nccs1
InChIInChI=1S/C13H17N3OS/c1-3-17-11-5-4-6-14-12(11)16-9-10(2)13-15-7-8-18-13/h4-8,10H,3,9H2,1-2H3,(H,14,16)
InChIKeyBTARAWJCRMYCGJ-UHFFFAOYSA-N
MW263.37 g/mol
LogP3.15
Rot. Bonds6

About 3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine

3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine (PubChem CID 114127933) has the molecular formula C13H17N3OS and a molecular weight of 263.37 g/mol. Its IUPAC name is 3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine.

Molecular Properties

Compound Name3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine
PubChem CID114127933
Molecular FormulaC13H17N3OS
Molecular Weight263.37 g/mol
Exact Mass263.11
IUPAC Name3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine
SMILESCCOc1cccnc1NCC(C)c1nccs1
InChIInChI=1S/C13H17N3OS/c1-3-17-11-5-4-6-14-12(11)16-9-10(2)13-15-7-8-18-13/h4-8,10H,3,9H2,1-2H3,(H,14,16)
InChIKeyBTARAWJCRMYCGJ-UHFFFAOYSA-N
XLogP3.15
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.37
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(1,3-thiazol-2-yl)propyl]pyrimidin-2-amine
CID 104577139
3-ethoxy-N-(2,2,3-trimethylbutyl)pyridin-2-amine
CID 114100789
3-methoxy-N-(1,3-thiazol-2-ylmethyl)pyridin-2-amine
CID 115868201
3-methoxy-N-[1-(1,3-thiazol-2-yl)ethyl]pyridin-2-amine
CID 115923076
3-methoxy-N-(2-phenylpropyl)pyridin-2-amine
CID 113430232
N-[2-(1,3-thiazol-2-yl)propyl]thieno[3,2-d]pyrimidin-4-amine
CID 104577253
3-[(3-ethoxy-2-pyridinyl)amino]-2-hydroxypropanamide
CID 106170981
3-propan-2-yloxy-N-[1-(1,3-thiazol-2-yl)ethyl]pyridin-2-amine
CID 112568503
4-methyl-3-nitro-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine
CID 104577201
3-[[(3-ethoxy-2-pyridinyl)amino]methyl]hexan-1-ol
CID 106115743
N-[(2-propan-2-yloxyphenyl)methyl]-2-(1,3-thiazol-2-yl)propan-1-amine
CID 104588784
6-methyl-2-[2-(1,3-thiazol-2-yl)propylamino]pyridine-3-carbonitrile
CID 104577151

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine?
The IUPAC name of 3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine (CID 114127933) is 3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine.
What is the SMILES notation for 3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine?
The canonical SMILES for 3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine is CCOc1cccnc1NCC(C)c1nccs1.
What is the InChIKey of 3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine?
The InChIKey is BTARAWJCRMYCGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3OS/c1-3-17-11-5-4-6-14-12(11)16-9-10(2)13-15-7-8-18-13/h4-8,10H,3,9H2,1-2H3,(H,14,16).
What are the key properties of 3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine?
3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine has a molecular weight of 263.37 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-[2-(1,3-thiazol-2-yl)propyl]pyridin-2-amine is sourced from PubChem (CID 114127933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).