1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine

C11H19N3S — CID 106741088

IUPAC1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine
SMILESCC1CC(CNCc2cscn2)CCN1
InChIInChI=1S/C11H19N3S/c1-9-4-10(2-3-13-9)5-12-6-11-7-15-8-14-11/h7-10,12-13H,2-6H2,1H3
InChIKeyNUTURNVJVDQWNR-UHFFFAOYSA-N
MW225.36 g/mol
LogP1.62
Rot. Bonds4

About 1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine

1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine (PubChem CID 106741088) has the molecular formula C11H19N3S and a molecular weight of 225.36 g/mol. Its IUPAC name is 1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine
PubChem CID106741088
Molecular FormulaC11H19N3S
Molecular Weight225.36 g/mol
Exact Mass225.13
IUPAC Name1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine
SMILESCC1CC(CNCc2cscn2)CCN1
InChIInChI=1S/C11H19N3S/c1-9-4-10(2-3-13-9)5-12-6-11-7-15-8-14-11/h7-10,12-13H,2-6H2,1H3
InChIKeyNUTURNVJVDQWNR-UHFFFAOYSA-N
XLogP1.62
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine
CID 106741005
2-piperidin-4-yl-N-(1,3-thiazol-4-ylmethyl)ethanamine
CID 63825914
3-cyclopropyl-N-(1,3-thiazol-4-ylmethyl)propan-1-amine
CID 115639498
1-cyclopropyl-N-[(2-methylpiperidin-4-yl)methyl]methanamine
CID 106740929
N-(1,3-thiazol-4-ylmethyl)ethanamine;dihydrochloride
CID 75485215
1-(2-bicyclo[2.2.1]heptanyl)-N-(1,3-thiazol-4-ylmethyl)methanamine
CID 62733747
3-piperidin-3-yl-N-(1,3-thiazol-4-ylmethyl)propan-1-amine
CID 63824137
2-pyrrolidin-2-yl-N-(1,3-thiazol-4-ylmethyl)acetamide
CID 63824820
1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine
CID 129473583
2-cyclopropyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine
CID 103700191
4-(1,3-thiazol-4-ylmethylamino)butan-1-ol
CID 106841033
2-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)ethanamine
CID 63902488

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine?
The IUPAC name of 1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine (CID 106741088) is 1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine.
What is the SMILES notation for 1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine?
The canonical SMILES for 1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine is CC1CC(CNCc2cscn2)CCN1.
What is the InChIKey of 1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine?
The InChIKey is NUTURNVJVDQWNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3S/c1-9-4-10(2-3-13-9)5-12-6-11-7-15-8-14-11/h7-10,12-13H,2-6H2,1H3.
What are the key properties of 1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine?
1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine has a molecular weight of 225.36 g/mol, XLogP of 1.62, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpiperidin-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine is sourced from PubChem (CID 106741088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).