N-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine

C11H19N3S — CID 115090979

IUPACN-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine
SMILESCNCc1cnc(CC2CCCCN2)s1
InChIInChI=1S/C11H19N3S/c1-12-7-10-8-14-11(15-10)6-9-4-2-3-5-13-9/h8-9,12-13H,2-7H2,1H3
InChIKeyNYVVCKPZOSPPCU-UHFFFAOYSA-N
MW225.36 g/mol
LogP1.55
Rot. Bonds4

About N-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine

N-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine (PubChem CID 115090979) has the molecular formula C11H19N3S and a molecular weight of 225.36 g/mol. Its IUPAC name is N-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine
PubChem CID115090979
Molecular FormulaC11H19N3S
Molecular Weight225.36 g/mol
Exact Mass225.13
IUPAC NameN-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine
SMILESCNCc1cnc(CC2CCCCN2)s1
InChIInChI=1S/C11H19N3S/c1-12-7-10-8-14-11(15-10)6-9-4-2-3-5-13-9/h8-9,12-13H,2-7H2,1H3
InChIKeyNYVVCKPZOSPPCU-UHFFFAOYSA-N
XLogP1.55
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 ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-cyclopropyl-2-(piperidin-2-ylmethyl)-1,3-thiazole
CID 115033672
1-(2-cyclopentyl-1,3-thiazol-5-yl)-N-methylmethanamine
CID 61281926
5-(1,1-difluoroethyl)-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 84795515
N-methyl-1-[2-[(1-propan-2-ylpiperidin-3-yl)methyl]-1,3-thiazol-5-yl]methanamine
CID 115091144
N-methyl-1-(2-propyl-1,3-thiazol-5-yl)methanamine
CID 61281146
5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
CID 84657560
ethane;N-methyl-1-piperidin-2-ylmethanamine
CID 144727857
N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-pyrrolidin-2-ylacetamide;dihydrochloride
CID 119896093
2-chloro-5-[[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]methyl]-1,3-thiazole
CID 97163900
1-[2-(3-ethylpiperidin-1-yl)-1,3-thiazol-5-yl]-N-methylmethanamine
CID 62751639
4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
CID 83838031
4-bromo-2-(piperidin-2-ylmethyl)-1,3-thiazole
CID 83693596

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine?
The IUPAC name of N-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine (CID 115090979) is N-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine?
The canonical SMILES for N-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine is CNCc1cnc(CC2CCCCN2)s1.
What is the InChIKey of N-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine?
The InChIKey is NYVVCKPZOSPPCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3S/c1-12-7-10-8-14-11(15-10)6-9-4-2-3-5-13-9/h8-9,12-13H,2-7H2,1H3.
What are the key properties of N-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine?
N-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine has a molecular weight of 225.36 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(piperidin-2-ylmethyl)-1,3-thiazol-5-yl]methanamine is sourced from PubChem (CID 115090979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).