3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine

C13H23N3OS — CID 170879214

IUPAC3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine
SMILESCCOc1nc(N2CCCCC2)sc1CCCN
InChIInChI=1S/C13H23N3OS/c1-2-17-12-11(7-6-8-14)18-13(15-12)16-9-4-3-5-10-16/h2-10,14H2,1H3
InChIKeyFCBWDVBMDYLTED-UHFFFAOYSA-N
MW269.41 g/mol
LogP2.42
Rot. Bonds6

About 3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine

3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine (PubChem CID 170879214) has the molecular formula C13H23N3OS and a molecular weight of 269.41 g/mol. Its IUPAC name is 3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine.

Molecular Properties

Compound Name3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine
PubChem CID170879214
Molecular FormulaC13H23N3OS
Molecular Weight269.41 g/mol
Exact Mass269.16
IUPAC Name3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine
SMILESCCOc1nc(N2CCCCC2)sc1CCCN
InChIInChI=1S/C13H23N3OS/c1-2-17-12-11(7-6-8-14)18-13(15-12)16-9-4-3-5-10-16/h2-10,14H2,1H3
InChIKeyFCBWDVBMDYLTED-UHFFFAOYSA-N
XLogP2.42
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.41
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(4-methyl-2-piperidin-1-yl-1,3-thiazol-5-yl)methanamine
CID 46785718
N-[[2-(azepan-1-yl)-4-propyl-1,3-thiazol-5-yl]methyl]ethanamine
CID 55112709
2-amino-3-(4-methoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propanoic acid
CID 170880284
3-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)propan-1-amine
CID 55113725
(4-cyclopropyl-2-piperidin-1-yl-1,3-thiazol-5-yl)methanamine
CID 63918102
ethyl 2-amino-3-(4-chloro-2-piperidin-1-yl-1,3-thiazol-5-yl)propanoate
CID 170884980
N-[(4-methyl-2-piperidin-1-yl-1,3-thiazol-5-yl)methyl]ethanamine
CID 46785724
ethyl 5-chloro-2-piperidin-1-yl-1,3-thiazole-4-carboxylate
CID 97035612
[2-(4-methyl-1,4-diazepan-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine
CID 62766388
5-(bromomethyl)-4-methyl-2-pyrrolidin-1-yl-1,3-thiazole
CID 82427860
N-[[2-(azocan-1-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-1-amine
CID 55117264
(4-phenyl-2-piperidin-1-yl-1,3-thiazol-5-yl)methanamine
CID 62765688

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine?
The IUPAC name of 3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine (CID 170879214) is 3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine.
What is the SMILES notation for 3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine?
The canonical SMILES for 3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine is CCOc1nc(N2CCCCC2)sc1CCCN.
What is the InChIKey of 3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine?
The InChIKey is FCBWDVBMDYLTED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3OS/c1-2-17-12-11(7-6-8-14)18-13(15-12)16-9-4-3-5-10-16/h2-10,14H2,1H3.
What are the key properties of 3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine?
3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine has a molecular weight of 269.41 g/mol, XLogP of 2.42, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxy-2-piperidin-1-yl-1,3-thiazol-5-yl)propan-1-amine is sourced from PubChem (CID 170879214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).