[6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine

C13H17N5S — CID 43528572

IUPAC[6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine
SMILESNCc1ccc(N2CCN(c3nccs3)CC2)nc1
InChIInChI=1S/C13H17N5S/c14-9-11-1-2-12(16-10-11)17-4-6-18(7-5-17)13-15-3-8-19-13/h1-3,8,10H,4-7,9,14H2
InChIKeyGYDLOFDGNJWCTK-UHFFFAOYSA-N
MW275.38 g/mol
LogP1.32
Rot. Bonds3

About [6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine

[6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine (PubChem CID 43528572) has the molecular formula C13H17N5S and a molecular weight of 275.38 g/mol. Its IUPAC name is [6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine
PubChem CID43528572
Molecular FormulaC13H17N5S
Molecular Weight275.38 g/mol
Exact Mass275.12
IUPAC Name[6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine
SMILESNCc1ccc(N2CCN(c3nccs3)CC2)nc1
InChIInChI=1S/C13H17N5S/c14-9-11-1-2-12(16-10-11)17-4-6-18(7-5-17)13-15-3-8-19-13/h1-3,8,10H,4-7,9,14H2
InChIKeyGYDLOFDGNJWCTK-UHFFFAOYSA-N
XLogP1.32
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[5-chloro-6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine
CID 62298416
[2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-1,3-thiazol-5-yl]methanamine
CID 62752365
2-[4-[6-(chloromethyl)pyridazin-3-yl]piperazin-1-yl]-1,3-thiazole
CID 61256786
(6-morpholin-4-yl-3-pyridinyl)methanamine;hydrochloride
CID 44784898
[6-(1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine
CID 43581088
[6-(4,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine
CID 62937885
N'-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]-4-(1,3-thiazol-2-yl)piperazine-1-carboximidamide
CID 111049160
[6-(1,4-oxazepan-4-yl)-3-pyridinyl]methanamine
CID 62988943
1-[5-(aminomethyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine;dihydrochloride
CID 69277737
[5-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]furan-2-yl]methanamine
CID 62423654
4-[5-(aminomethyl)-2-pyridinyl]-N,N-dimethylpiperazine-1-sulfonamide
CID 107355689
4-[5-(aminomethyl)-2-pyridinyl]-N-methylpiperazine-1-sulfonamide
CID 107355681

Frequently Asked Questions

What is the IUPAC name of [6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine?
The IUPAC name of [6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine (CID 43528572) is [6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine.
What is the SMILES notation for [6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine?
The canonical SMILES for [6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine is NCc1ccc(N2CCN(c3nccs3)CC2)nc1.
What is the InChIKey of [6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine?
The InChIKey is GYDLOFDGNJWCTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5S/c14-9-11-1-2-12(16-10-11)17-4-6-18(7-5-17)13-15-3-8-19-13/h1-3,8,10H,4-7,9,14H2.
What are the key properties of [6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine?
[6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine has a molecular weight of 275.38 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-3-pyridinyl]methanamine is sourced from PubChem (CID 43528572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).