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

C14H19N3S2 — CID 63644443

IUPACN-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine
SMILESCN(Cc1csc(-c2ccsc2)n1)C1CCCNC1
InChIInChI=1S/C14H19N3S2/c1-17(13-3-2-5-15-7-13)8-12-10-19-14(16-12)11-4-6-18-9-11/h4,6,9-10,13,15H,2-3,5,7-8H2,1H3
InChIKeyDPTBKMUHUSMFRZ-UHFFFAOYSA-N
MW293.46 g/mol
LogP3.06
Rot. Bonds4

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

N-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine (PubChem CID 63644443) has the molecular formula C14H19N3S2 and a molecular weight of 293.46 g/mol. Its IUPAC name is N-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine.

Molecular Properties

Compound NameN-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine
PubChem CID63644443
Molecular FormulaC14H19N3S2
Molecular Weight293.46 g/mol
Exact Mass293.10
IUPAC NameN-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine
SMILESCN(Cc1csc(-c2ccsc2)n1)C1CCCNC1
InChIInChI=1S/C14H19N3S2/c1-17(13-3-2-5-15-7-13)8-12-10-19-14(16-12)11-4-6-18-9-11/h4,6,9-10,13,15H,2-3,5,7-8H2,1H3
InChIKeyDPTBKMUHUSMFRZ-UHFFFAOYSA-N
XLogP3.06
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.46
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[[4-(Thiophen-3-ylmethyl)piperazin-1-yl]methyl]-1,3-thiazole
CID 53516942
1-{[2-(Thiophen-3-yl)-1,3-thiazol-4-yl]methyl}piperazine
CID 16227456
1-(2-(Thiophen-3-yl)-1,3-thiazol-4-yl)methanamine dihydrochloride
CID 165993978
2,2,6,6-tetramethyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine
CID 75413341
1-[(3R)-1-ethylpyrrolidin-3-yl]-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]methanamine
CID 97028745
[2-(Thiophen-3-yl)-1,3-thiazol-4-yl]methanamine
CID 60672525
1-Ethyl-3-[1-(thiophen-3-ylmethyl)piperidin-4-yl]-2-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]guanidine
CID 112081575
2-Methyl-1-[1-(thiophen-3-ylmethyl)piperidin-4-yl]-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]guanidine
CID 112081601
2-Methyl-1-[1-(thiophen-3-ylmethyl)piperidin-4-yl]-3-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]guanidine;hydroiodide
CID 112183850
2-Methyl-1-[1-(thiophen-3-ylmethyl)piperidin-4-yl]-3-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]guanidine
CID 112183851
1,1,1-Trifluoro-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)propan-2-amine
CID 113461182
2,2,2-trifluoro-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]ethanamine
CID 115574424

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine?
The IUPAC name of N-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine (CID 63644443) is N-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine.
What is the SMILES notation for N-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine?
The canonical SMILES for N-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine is CN(Cc1csc(-c2ccsc2)n1)C1CCCNC1.
What is the InChIKey of N-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine?
The InChIKey is DPTBKMUHUSMFRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3S2/c1-17(13-3-2-5-15-7-13)8-12-10-19-14(16-12)11-4-6-18-9-11/h4,6,9-10,13,15H,2-3,5,7-8H2,1H3.
What are the key properties of N-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine?
N-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine has a molecular weight of 293.46 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-amine is sourced from PubChem (CID 63644443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).