4-methylpyridine;thiophene

C10H11NS — CID 145224941

IUPAC4-methylpyridine;thiophene
SMILESCc1ccncc1.c1ccsc1
InChIInChI=1S/C6H7N.C4H4S/c1-6-2-4-7-5-3-6;1-2-4-5-3-1/h2-5H,1H3;1-4H
InChIKeyVUURIRMMQKTELR-UHFFFAOYSA-N
MW177.27 g/mol
LogP3.14
Rot. Bonds

About 4-methylpyridine;thiophene

4-methylpyridine;thiophene (PubChem CID 145224941) has the molecular formula C10H11NS and a molecular weight of 177.27 g/mol. Its IUPAC name is 4-methylpyridine;thiophene.

Molecular Properties

Compound Name4-methylpyridine;thiophene
PubChem CID145224941
Molecular FormulaC10H11NS
Molecular Weight177.27 g/mol
Exact Mass177.06
IUPAC Name4-methylpyridine;thiophene
SMILESCc1ccncc1.c1ccsc1
InChIInChI=1S/C6H7N.C4H4S/c1-6-2-4-7-5-3-6;1-2-4-5-3-1/h2-5H,1H3;1-4H
InChIKeyVUURIRMMQKTELR-UHFFFAOYSA-N
XLogP3.14
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.27
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

CID 160727220
CID 160727220
tetrakis(4-methylpyridine);nickel
CID 160730254
ethane;4-methylpyridine
CID 54305436
bis(4-methylpyridine);platinum(2+);dichloride
CID 170853957
deuterium monohydride;4-methylpyridine
CID 175130450
ethane;thiophene;toluene
CID 142047942
N,N-dimethylmethanamine;4-methylpyridine
CID 22155636
4-methylpyridine;4-pyridin-4-ylpyridine
CID 118057744
(E)-but-2-ene;4-methylpyridine;platinum(2+);dichloride
CID 171377193
3-methylpyridine;4-methylpyridine
CID 21425791
isocyanic acid;4-methylpyridine
CID 174958459
formic acid;4-methylpyridine
CID 162172361

Frequently Asked Questions

What is the IUPAC name of 4-methylpyridine;thiophene?
The IUPAC name of 4-methylpyridine;thiophene (CID 145224941) is 4-methylpyridine;thiophene.
What is the SMILES notation for 4-methylpyridine;thiophene?
The canonical SMILES for 4-methylpyridine;thiophene is Cc1ccncc1.c1ccsc1.
What is the InChIKey of 4-methylpyridine;thiophene?
The InChIKey is VUURIRMMQKTELR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N.C4H4S/c1-6-2-4-7-5-3-6;1-2-4-5-3-1/h2-5H,1H3;1-4H.
What are the key properties of 4-methylpyridine;thiophene?
4-methylpyridine;thiophene has a molecular weight of 177.27 g/mol, XLogP of 3.14, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylpyridine;thiophene is sourced from PubChem (CID 145224941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).