1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine

C14H25N3S — CID 83055721

IUPAC1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine
SMILESCCCC1CCCCN1Cc1csc(C(C)N)n1
InChIInChI=1S/C14H25N3S/c1-3-6-13-7-4-5-8-17(13)9-12-10-18-14(16-12)11(2)15/h10-11,13H,3-9,15H2,1-2H3
InChIKeyUVJFBWKQFACIAC-UHFFFAOYSA-N
MW267.44 g/mol
LogP3.32
Rot. Bonds5

About 1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine

1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine (PubChem CID 83055721) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is 1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine.

Molecular Properties

Compound Name1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine
PubChem CID83055721
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC Name1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine
SMILESCCCC1CCCCN1Cc1csc(C(C)N)n1
InChIInChI=1S/C14H25N3S/c1-3-6-13-7-4-5-8-17(13)9-12-10-18-14(16-12)11(2)15/h10-11,13H,3-9,15H2,1-2H3
InChIKeyUVJFBWKQFACIAC-UHFFFAOYSA-N
XLogP3.32
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]methyl]propan-1-amine
CID 83044336
2-methyl-N-[[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]methyl]propan-2-amine
CID 83046678
1-[4-[(4-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine
CID 66388837
1-[1-[(2-ethyl-1,3-thiazol-4-yl)methyl]azepan-2-yl]propan-2-ol
CID 114338946
N-[[4-[(2-ethylazepan-1-yl)methyl]-1,3-thiazol-2-yl]methyl]propan-2-amine
CID 104692365
1-[4-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-ylmethyl)-1,3-thiazol-2-yl]ethanamine
CID 79934712
1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol
CID 111333364
4-[(2-ethylazepan-1-yl)methyl]-1,3-thiazole-2-carboxylic acid
CID 104690534
(1R)-1-(4-ethyl-1,3-thiazol-2-yl)ethanamine
CID 42077975
1-[1-[(4-propyl-1,3-thiazol-2-yl)methyl]piperidin-2-yl]ethanamine
CID 120897022
1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol
CID 111434600
1-[4-[(4-tert-butylazepan-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine
CID 66384874

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine?
The IUPAC name of 1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine (CID 83055721) is 1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine.
What is the SMILES notation for 1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine?
The canonical SMILES for 1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine is CCCC1CCCCN1Cc1csc(C(C)N)n1.
What is the InChIKey of 1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine?
The InChIKey is UVJFBWKQFACIAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-3-6-13-7-4-5-8-17(13)9-12-10-18-14(16-12)11(2)15/h10-11,13H,3-9,15H2,1-2H3.
What are the key properties of 1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine?
1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine has a molecular weight of 267.44 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine is sourced from PubChem (CID 83055721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).