6-amino-5-methyl-1H-pyridine-2-thione;ethane

C8H14N2S — CID 142420612

IUPAC6-amino-5-methyl-1H-pyridine-2-thione;ethane
SMILESCC.Cc1ccc(=S)[nH]c1N
InChIInChI=1S/C6H8N2S.C2H6/c1-4-2-3-5(9)8-6(4)7;1-2/h2-3H,1H3,(H3,7,8,9);1-2H3
InChIKeyXUHRGKFHHDRMPO-UHFFFAOYSA-N
MW170.28 g/mol
LogP2.66
Rot. Bonds

About 6-amino-5-methyl-1H-pyridine-2-thione;ethane

6-amino-5-methyl-1H-pyridine-2-thione;ethane (PubChem CID 142420612) has the molecular formula C8H14N2S and a molecular weight of 170.28 g/mol. Its IUPAC name is 6-amino-5-methyl-1H-pyridine-2-thione;ethane.

Molecular Properties

Compound Name6-amino-5-methyl-1H-pyridine-2-thione;ethane
PubChem CID142420612
Molecular FormulaC8H14N2S
Molecular Weight170.28 g/mol
Exact Mass170.09
IUPAC Name6-amino-5-methyl-1H-pyridine-2-thione;ethane
SMILESCC.Cc1ccc(=S)[nH]c1N
InChIInChI=1S/C6H8N2S.C2H6/c1-4-2-3-5(9)8-6(4)7;1-2/h2-3H,1H3,(H3,7,8,9);1-2H3
InChIKeyXUHRGKFHHDRMPO-UHFFFAOYSA-N
XLogP2.66
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.28
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Related Compounds

1-Amino-3-mercaptoisoquinoline
CID 86277548
2-Amino-3,5-cyano-6-thiopyridine
CID 119024063
6-amino-5-(trifluoromethyl)-1H-pyridine-2-thione
CID 119002305
(3-Methylidenecyclohexa-1,5-dien-1-yl)thiourea
CID 57160471
2-amino-4-[(E)-but-1-enyl]-6-sulfanylidene-1H-pyridine-3-carbonitrile
CID 70915048
5-(1-aminoethenyl)-6-methyl-1H-pyridine-2-thione
CID 139438688
6-amino-5-methyl-1H-pyridine-2-thione
CID 142420613
[(3E)-5-methylhexa-1,3,5-trien-3-yl]thiourea
CID 143184467
6-amino-5-ethyl-1H-pyridine-2-thione
CID 151844198
5-ethenyl-3-methyl-6-(methylamino)-1H-pyridine-2-thione
CID 156641517
5-ethenyl-6-methyl-1H-pyridine-2-thione
CID 102546406
1,8-Dihydro-1,8-naphthyridine-2,7-dithione
CID 172415549

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-methyl-1H-pyridine-2-thione;ethane?
The IUPAC name of 6-amino-5-methyl-1H-pyridine-2-thione;ethane (CID 142420612) is 6-amino-5-methyl-1H-pyridine-2-thione;ethane.
What is the SMILES notation for 6-amino-5-methyl-1H-pyridine-2-thione;ethane?
The canonical SMILES for 6-amino-5-methyl-1H-pyridine-2-thione;ethane is CC.Cc1ccc(=S)[nH]c1N.
What is the InChIKey of 6-amino-5-methyl-1H-pyridine-2-thione;ethane?
The InChIKey is XUHRGKFHHDRMPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2S.C2H6/c1-4-2-3-5(9)8-6(4)7;1-2/h2-3H,1H3,(H3,7,8,9);1-2H3.
What are the key properties of 6-amino-5-methyl-1H-pyridine-2-thione;ethane?
6-amino-5-methyl-1H-pyridine-2-thione;ethane has a molecular weight of 170.28 g/mol, XLogP of 2.66, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-methyl-1H-pyridine-2-thione;ethane is sourced from PubChem (CID 142420612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).