N,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine

C13H23N3S — CID 63242579

IUPACN,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine
SMILESCNC1CCN(CCc2nc(C)cs2)CC1C
InChIInChI=1S/C13H23N3S/c1-10-8-16(6-4-12(10)14-3)7-5-13-15-11(2)9-17-13/h9-10,12,14H,4-8H2,1-3H3
InChIKeyPQBKNUUWNUOGBE-UHFFFAOYSA-N
MW253.41 g/mol
LogP1.92
Rot. Bonds4

About N,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine

N,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine (PubChem CID 63242579) has the molecular formula C13H23N3S and a molecular weight of 253.41 g/mol. Its IUPAC name is N,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine.

Molecular Properties

Compound NameN,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine
PubChem CID63242579
Molecular FormulaC13H23N3S
Molecular Weight253.41 g/mol
Exact Mass253.16
IUPAC NameN,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine
SMILESCNC1CCN(CCc2nc(C)cs2)CC1C
InChIInChI=1S/C13H23N3S/c1-10-8-16(6-4-12(10)14-3)7-5-13-15-11(2)9-17-13/h9-10,12,14H,4-8H2,1-3H3
InChIKeyPQBKNUUWNUOGBE-UHFFFAOYSA-N
XLogP1.92
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.41
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,3-dimethyl-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidin-4-amine
CID 106042299
N,2,3-trimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine
CID 79406895
N-ethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine
CID 63242491
N,3-dimethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine
CID 107910883
N-methyl-1-[2-(1,3-thiazol-2-yl)ethyl]pyrrolidin-3-amine
CID 63242038
(3R,4S)-1-ethyl-N,3-dimethylpiperidin-4-amine
CID 94244956
3-[3-methyl-4-(methylamino)piperidin-1-yl]propan-1-ol
CID 114499058
1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-N,3-dimethylpiperidin-4-amine
CID 114499067
2-[2-(3-butan-2-yl-1,4-diazepan-1-yl)ethyl]-4-methyl-1,3-thiazole
CID 64948802
1-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-N,3-dimethylpiperidin-4-amine
CID 114180494
[2-[2-(4-methylpiperidin-1-yl)ethyl]-1,3-thiazol-4-yl]methanamine
CID 82515255
2-[2-(2,5-dimethylpiperazin-1-yl)ethyl]-4-methyl-1,3-thiazole
CID 64936843

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine?
The IUPAC name of N,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine (CID 63242579) is N,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine.
What is the SMILES notation for N,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine?
The canonical SMILES for N,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine is CNC1CCN(CCc2nc(C)cs2)CC1C.
What is the InChIKey of N,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine?
The InChIKey is PQBKNUUWNUOGBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3S/c1-10-8-16(6-4-12(10)14-3)7-5-13-15-11(2)9-17-13/h9-10,12,14H,4-8H2,1-3H3.
What are the key properties of N,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine?
N,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine has a molecular weight of 253.41 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidin-4-amine is sourced from PubChem (CID 63242579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).