N-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine

C10H17N3S — CID 166707308

IUPACN-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine
SMILESCC/N=c1\sccn1C1CCNCC1
InChIInChI=1S/C10H17N3S/c1-2-12-10-13(7-8-14-10)9-3-5-11-6-4-9/h7-9,11H,2-6H2,1H3/b12-10-
InChIKeyWJAPWLAPPGLDNP-BENRWUELSA-N
MW211.33 g/mol
LogP1.39
Rot. Bonds2

About N-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine

N-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine (PubChem CID 166707308) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is N-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine.

Molecular Properties

Compound NameN-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine
PubChem CID166707308
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC NameN-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine
SMILESCC/N=c1\sccn1C1CCNCC1
InChIInChI=1S/C10H17N3S/c1-2-12-10-13(7-8-14-10)9-3-5-11-6-4-9/h7-9,11H,2-6H2,1H3/b12-10-
InChIKeyWJAPWLAPPGLDNP-BENRWUELSA-N
XLogP1.39
TPSA29.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethenyl N-(1-methylpiperidin-4-yl)-N'-[2-[methyl(sulfanyl)amino]ethyl]carbamimidothioate
CID 130240683
ethane;ethenyl 4-(2-aminoethylamino)-N-methylpiperidine-1-carboximidothioate
CID 141933297
N-[3-(2-methylpiperidin-1-yl)propyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 43148964
N-(1-methylpiperidin-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43373638
5-methyl-N-[3-(2-methylpiperidin-1-yl)propyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 43439843
5-methyl-N-(1-methylpiperidin-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43440177
4-ethyl-N-(1-methylpiperidin-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43440180
4-ethyl-N-(1-propylpiperidin-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 54968131
N-(1-propylpiperidin-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 61512419
5-methyl-N-(1-propylpiperidin-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 61512485
N-(1,2-dimethylpiperidin-4-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 81629056
N-(1,2-dimethylpiperidin-4-yl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
CID 81629484

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine?
The IUPAC name of N-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine (CID 166707308) is N-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine.
What is the SMILES notation for N-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine?
The canonical SMILES for N-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine is CC/N=c1\sccn1C1CCNCC1.
What is the InChIKey of N-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine?
The InChIKey is WJAPWLAPPGLDNP-BENRWUELSA-N. The full InChI is InChI=1S/C10H17N3S/c1-2-12-10-13(7-8-14-10)9-3-5-11-6-4-9/h7-9,11H,2-6H2,1H3/b12-10-.
What are the key properties of N-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine?
N-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine has a molecular weight of 211.33 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-piperidin-4-yl-1,3-thiazol-2-imine is sourced from PubChem (CID 166707308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).