4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine

C14H25N3S — CID 65169907

IUPAC4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine
SMILESCc1nc(NCC(C)CN2CCCCC2)sc1C
InChIInChI=1S/C14H25N3S/c1-11(10-17-7-5-4-6-8-17)9-15-14-16-12(2)13(3)18-14/h11H,4-10H2,1-3H3,(H,15,16)
InChIKeyVJIUZUWCZKUNDE-UHFFFAOYSA-N
MW267.44 g/mol
LogP3.29
Rot. Bonds5

About 4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine

4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine (PubChem CID 65169907) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is 4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine
PubChem CID65169907
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC Name4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine
SMILESCc1nc(NCC(C)CN2CCCCC2)sc1C
InChIInChI=1S/C14H25N3S/c1-11(10-17-7-5-4-6-8-17)9-15-14-16-12(2)13(3)18-14/h11H,4-10H2,1-3H3,(H,15,16)
InChIKeyVJIUZUWCZKUNDE-UHFFFAOYSA-N
XLogP3.29
TPSA28.16 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 ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine
CID 65268166
N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-benzothiazol-2-amine
CID 47283339
3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine
CID 65271588
5-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,3-benzothiazol-2-amine
CID 62992189
2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-1,3-thiazole-5-carboxylic acid
CID 80571368
3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine
CID 62993510
6-methyl-N-(2-methyl-3-piperidin-1-ylpropyl)-2-propan-2-ylpyrimidin-4-amine
CID 60967444
6-hydrazinyl-2,5-dimethyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine
CID 80914851
3-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-1-piperidin-1-ylpropan-1-one
CID 113254660
ethyl 2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-1,3-thiazole-4-carboxylate
CID 80568601
4,5-dimethyl-N-(2-methylsulfinylpropyl)-1,3-thiazol-2-amine
CID 115764279
ethyl 2-[2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-1,3-thiazol-4-yl]acetate
CID 80574664

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine?
The IUPAC name of 4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine (CID 65169907) is 4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine is Cc1nc(NCC(C)CN2CCCCC2)sc1C.
What is the InChIKey of 4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine?
The InChIKey is VJIUZUWCZKUNDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-11(10-17-7-5-4-6-8-17)9-15-14-16-12(2)13(3)18-14/h11H,4-10H2,1-3H3,(H,15,16).
What are the key properties of 4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine?
4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine has a molecular weight of 267.44 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 65169907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).