5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine

C14H25N3S — CID 79771437

IUPAC5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine
SMILESCCCNc1ncc(CN2C(C)CCCC2C)s1
InChIInChI=1S/C14H25N3S/c1-4-8-15-14-16-9-13(18-14)10-17-11(2)6-5-7-12(17)3/h9,11-12H,4-8,10H2,1-3H3,(H,15,16)
InChIKeyHIJGKAYIFSSJPS-UHFFFAOYSA-N
MW267.44 g/mol
LogP3.73
Rot. Bonds5

About 5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine

5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine (PubChem CID 79771437) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is 5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine
PubChem CID79771437
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC Name5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine
SMILESCCCNc1ncc(CN2C(C)CCCC2C)s1
InChIInChI=1S/C14H25N3S/c1-4-8-15-14-16-9-13(18-14)10-17-11(2)6-5-7-12(17)3/h9,11-12H,4-8,10H2,1-3H3,(H,15,16)
InChIKeyHIJGKAYIFSSJPS-UHFFFAOYSA-N
XLogP3.73
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 ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine
CID 104968911
5-[(2,6-dimethylthiomorpholin-4-yl)methyl]-N-propyl-1,3-thiazol-2-amine
CID 79771395
5-[(4-propan-2-ylazepan-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine
CID 79772633
5-(2-cyclobutylethoxymethyl)-N-propyl-1,3-thiazol-2-amine
CID 114157919
5-ethyl-N-propyl-1,3-thiazol-2-amine
CID 62943674
1-[1-[[2-(propylamino)-1,3-thiazol-5-yl]methyl]piperidin-4-yl]ethanol
CID 106837645
5-[(3-methoxypiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine
CID 102966743
5-(1,4-oxazepan-4-ylmethyl)-N-propyl-1,3-thiazol-2-amine
CID 79771866
N-methyl-5-[2-[2-(propylamino)-1,3-thiazol-5-yl]ethyl]-1,3-thiazol-2-amine
CID 79774348
5-(cycloheptyloxymethyl)-N-propyl-1,3-thiazol-2-amine
CID 79774505
5-[[cyclobutylmethyl(ethyl)amino]methyl]-N-propyl-1,3-thiazol-2-amine
CID 107401418
5-[(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)methyl]-N-propyl-1,3-thiazol-2-amine
CID 79774545

Frequently Asked Questions

What is the IUPAC name of 5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine?
The IUPAC name of 5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine (CID 79771437) is 5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine is CCCNc1ncc(CN2C(C)CCCC2C)s1.
What is the InChIKey of 5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine?
The InChIKey is HIJGKAYIFSSJPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-4-8-15-14-16-9-13(18-14)10-17-11(2)6-5-7-12(17)3/h9,11-12H,4-8,10H2,1-3H3,(H,15,16).
What are the key properties of 5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine?
5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine has a molecular weight of 267.44 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,6-dimethylpiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine is sourced from PubChem (CID 79771437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).