CID 123180538

CH7NS — CID 123180538

IUPAC—
SMILESCN.[3H]S
InChIInChI=1S/CH5N.H2S/c1-2;/h2H2,1H3;1H2/i/hT
InChIKeyRWVHWIUMDYZAPF-MNYXATJNSA-N
MW67.15 g/mol
LogP-0.31
Rot. Bonds

About CID 123180538

CID 123180538 (PubChem CID 123180538) has the molecular formula CH7NS and a molecular weight of 67.15 g/mol.

Molecular Properties

Compound NameCID 123180538
PubChem CID123180538
Molecular FormulaCH7NS
Molecular Weight67.15 g/mol
Exact Mass67.04
IUPAC Name—
SMILESCN.[3H]S
InChIInChI=1S/CH5N.H2S/c1-2;/h2H2,1H3;1H2/i/hT
InChIKeyRWVHWIUMDYZAPF-MNYXATJNSA-N
XLogP-0.31
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50067.15
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 123180538?
The IUPAC name of CID 123180538 (CID 123180538) is not available.
What is the SMILES notation for CID 123180538?
The canonical SMILES for CID 123180538 is CN.[3H]S.
What is the InChIKey of CID 123180538?
The InChIKey is RWVHWIUMDYZAPF-MNYXATJNSA-N. The full InChI is InChI=1S/CH5N.H2S/c1-2;/h2H2,1H3;1H2/i/hT.
What are the key properties of CID 123180538?
CID 123180538 has a molecular weight of 67.15 g/mol, XLogP of -0.31, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 123180538 is sourced from PubChem (CID 123180538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).