N-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine

C10H14N2S2 — CID 62058118

IUPACN-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCc1ccc(CNC2=NCCCS2)s1
InChIInChI=1S/C10H14N2S2/c1-8-3-4-9(14-8)7-12-10-11-5-2-6-13-10/h3-4H,2,5-7H2,1H3,(H,11,12)
InChIKeyKFSFJPFGYFVEDA-UHFFFAOYSA-N
MW226.37 g/mol
LogP2.64
Rot. Bonds2

About N-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine

N-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 62058118) has the molecular formula C10H14N2S2 and a molecular weight of 226.37 g/mol. Its IUPAC name is N-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound NameN-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID62058118
Molecular FormulaC10H14N2S2
Molecular Weight226.37 g/mol
Exact Mass226.06
IUPAC NameN-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCc1ccc(CNC2=NCCCS2)s1
InChIInChI=1S/C10H14N2S2/c1-8-3-4-9(14-8)7-12-10-11-5-2-6-13-10/h3-4H,2,5-7H2,1H3,(H,11,12)
InChIKeyKFSFJPFGYFVEDA-UHFFFAOYSA-N
XLogP2.64
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.37
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-methylthiophen-2-yl)methyl]-1,4,5,6-tetrahydropyrimidin-2-amine;hydroiodide
CID 110916021
N-(1,2-oxazol-5-ylmethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 106420088
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 79238240
5-methyl-N-[(5-methylthiophen-2-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 64982707
N-(naphthalen-1-ylmethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 62368128
4-[(5,6-dihydro-4H-1,3-thiazin-2-ylamino)methyl]benzonitrile
CID 62268458
4-[(5,6-dihydro-4H-1,3-thiazin-2-ylamino)methyl]benzenesulfonamide
CID 29068145
N-[(5-methylthiophen-2-yl)methyl]pyridin-4-amine
CID 62057971
5-methyl-N-[(5-methylthiophen-2-yl)methyl]pyrimidin-2-amine
CID 63208187
N-[(5-methylthiophen-2-yl)methyl]-1,2,4-thiadiazol-5-amine
CID 65277074
4-chloro-N-[(5-methylthiophen-2-yl)methyl]-1,2,5-thiadiazol-3-amine
CID 62057962
3-chloro-N-[(5-methylthiophen-2-yl)methyl]pyrazin-2-amine
CID 62057964

Frequently Asked Questions

What is the IUPAC name of N-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of N-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 62058118) is N-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for N-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for N-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine is Cc1ccc(CNC2=NCCCS2)s1.
What is the InChIKey of N-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is KFSFJPFGYFVEDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2S2/c1-8-3-4-9(14-8)7-12-10-11-5-2-6-13-10/h3-4H,2,5-7H2,1H3,(H,11,12).
What are the key properties of N-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
N-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 226.37 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylthiophen-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 62058118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).