CID 146162012

C8H8NS — CID 146162012

IUPAC—
SMILESCC1=N[C]2C=CC=CC2S1
InChIInChI=1S/C8H8NS/c1-6-9-7-4-2-3-5-8(7)10-6/h2-5,8H,1H3
InChIKeyCXXLZYRRJIHGTA-UHFFFAOYSA-N
MW150.23 g/mol
LogP2.18
Rot. Bonds

About CID 146162012

CID 146162012 (PubChem CID 146162012) has the molecular formula C8H8NS and a molecular weight of 150.23 g/mol.

Molecular Properties

Compound NameCID 146162012
PubChem CID146162012
Molecular FormulaC8H8NS
Molecular Weight150.23 g/mol
Exact Mass150.04
IUPAC Name—
SMILESCC1=N[C]2C=CC=CC2S1
InChIInChI=1S/C8H8NS/c1-6-9-7-4-2-3-5-8(7)10-6/h2-5,8H,1H3
InChIKeyCXXLZYRRJIHGTA-UHFFFAOYSA-N
XLogP2.18
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.23
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 146162012?
The IUPAC name of CID 146162012 (CID 146162012) is not available.
What is the SMILES notation for CID 146162012?
The canonical SMILES for CID 146162012 is CC1=N[C]2C=CC=CC2S1.
What is the InChIKey of CID 146162012?
The InChIKey is CXXLZYRRJIHGTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8NS/c1-6-9-7-4-2-3-5-8(7)10-6/h2-5,8H,1H3.
What are the key properties of CID 146162012?
CID 146162012 has a molecular weight of 150.23 g/mol, XLogP of 2.18, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 146162012 is sourced from PubChem (CID 146162012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).