[1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine

C11H19N3S — CID 50987749

IUPAC[1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine
SMILESCc1nc(CN2CCC(CN)CC2)cs1
InChIInChI=1S/C11H19N3S/c1-9-13-11(8-15-9)7-14-4-2-10(6-12)3-5-14/h8,10H,2-7,12H2,1H3
InChIKeyZEYZIFKDRCDRKU-UHFFFAOYSA-N
MW225.36 g/mol
LogP1.62
Rot. Bonds3

About [1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine

[1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine (PubChem CID 50987749) has the molecular formula C11H19N3S and a molecular weight of 225.36 g/mol. Its IUPAC name is [1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine.

Molecular Properties

Compound Name[1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine
PubChem CID50987749
Molecular FormulaC11H19N3S
Molecular Weight225.36 g/mol
Exact Mass225.13
IUPAC Name[1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine
SMILESCc1nc(CN2CCC(CN)CC2)cs1
InChIInChI=1S/C11H19N3S/c1-9-13-11(8-15-9)7-14-4-2-10(6-12)3-5-14/h8,10H,2-7,12H2,1H3
InChIKeyZEYZIFKDRCDRKU-UHFFFAOYSA-N
XLogP1.62
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Isopropyl-4-(N-methyl)amino-methyl thiazole
CID 10749687
4-[(3-Methylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine
CID 3871137
4-[(4-Methylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine
CID 2546218
1-((2-Methyl-1,3-thiazol-4-yl)methyl)piperazine
CID 16227460
1-((1,3-Thiazol-4-yl)methyl)piperidin-4-amine
CID 43556525
4-(Piperidin-1-ylmethyl)-2-propan-2-yl-1,3-thiazole
CID 53523916
1-[(2-Methyl-1,3-thiazol-4-yl)methyl]piperidine
CID 5019947
2-Isopropyl-4-((N-Methylamino)Methyl)Thiazole Hydrochloride
CID 11622565
4-[(3,5-Dimethylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine
CID 16227645
4-(4-Methyl-1,3-thiazol-2-yl)piperidine
CID 23404938
3-(4-Methyl-1,3-thiazol-2-yl)piperidine
CID 24261803
4-(4-Ethyl-1,3-thiazol-2-yl)piperidine
CID 24261827

Frequently Asked Questions

What is the IUPAC name of [1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine?
The IUPAC name of [1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine (CID 50987749) is [1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine.
What is the SMILES notation for [1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine?
The canonical SMILES for [1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine is Cc1nc(CN2CCC(CN)CC2)cs1.
What is the InChIKey of [1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine?
The InChIKey is ZEYZIFKDRCDRKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3S/c1-9-13-11(8-15-9)7-14-4-2-10(6-12)3-5-14/h8,10H,2-7,12H2,1H3.
What are the key properties of [1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine?
[1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine has a molecular weight of 225.36 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine is sourced from PubChem (CID 50987749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).