[(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine

C9H17N3S — CID 129493284

IUPAC[(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine
SMILESNC[C@H]1CCCN(C2=NCCS2)C1
InChIInChI=1S/C9H17N3S/c10-6-8-2-1-4-12(7-8)9-11-3-5-13-9/h8H,1-7,10H2/t8-/m1/s1
InChIKeyJLEDHHVFHGBPHM-MRVPVSSYSA-N
MW199.32 g/mol
LogP0.76
Rot. Bonds1

About [(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine

[(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine (PubChem CID 129493284) has the molecular formula C9H17N3S and a molecular weight of 199.32 g/mol. Its IUPAC name is [(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine.

Molecular Properties

Compound Name[(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine
PubChem CID129493284
Molecular FormulaC9H17N3S
Molecular Weight199.32 g/mol
Exact Mass199.11
IUPAC Name[(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine
SMILESNC[C@H]1CCCN(C2=NCCS2)C1
InChIInChI=1S/C9H17N3S/c10-6-8-2-1-4-12(7-8)9-11-3-5-13-9/h8H,1-7,10H2/t8-/m1/s1
InChIKeyJLEDHHVFHGBPHM-MRVPVSSYSA-N
XLogP0.76
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.32
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3R)-3-ethoxypyrrolidin-1-yl]-4,5-dihydro-1,3-thiazole
CID 142277547
[1-(1-propan-2-ylimidazol-2-yl)piperidin-3-yl]methanamine
CID 106552327
(1-pyridin-3-ylpiperidin-3-yl)methanamine
CID 83818099
1-(4,5-dihydro-1,3-thiazol-2-yl)azetidine-3-thiol;hydrochloride
CID 11974883
[1-(1-methylimidazol-2-yl)piperidin-3-yl]methanamine
CID 62132389
[1-(1-methylpyrazol-3-yl)piperidin-3-yl]methanamine
CID 112708877
[1-[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]piperidin-3-yl]methanamine
CID 102800042
[3-[3-(aminomethyl)piperidin-1-yl]-1H-1,2,4-triazol-5-yl]methanol
CID 102799874
[(3R)-1-cyclopentylpiperidin-3-yl]methanamine
CID 27440320
3-[(3S)-3-(aminomethyl)piperidin-1-yl]quinoxalin-2-amine
CID 97165472
[1-(2-fluorophenyl)azepan-3-yl]methanamine
CID 84687805
[1-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]piperidin-3-yl]methanamine
CID 102799873

Frequently Asked Questions

What is the IUPAC name of [(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine?
The IUPAC name of [(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine (CID 129493284) is [(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine.
What is the SMILES notation for [(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine?
The canonical SMILES for [(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine is NC[C@H]1CCCN(C2=NCCS2)C1.
What is the InChIKey of [(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine?
The InChIKey is JLEDHHVFHGBPHM-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H17N3S/c10-6-8-2-1-4-12(7-8)9-11-3-5-13-9/h8H,1-7,10H2/t8-/m1/s1.
What are the key properties of [(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine?
[(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine has a molecular weight of 199.32 g/mol, XLogP of 0.76, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-1-(4,5-dihydro-1,3-thiazol-2-yl)piperidin-3-yl]methanamine is sourced from PubChem (CID 129493284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).