1H-pyrrol-2-amine;thiophene

C8H10N2S — CID 174932440

IUPAC1H-pyrrol-2-amine;thiophene
SMILESNc1ccc[nH]1.c1ccsc1
InChIInChI=1S/C4H6N2.C4H4S/c5-4-2-1-3-6-4;1-2-4-5-3-1/h1-3,6H,5H2;1-4H
InChIKeyRXLCLRQNBGGIID-UHFFFAOYSA-N
MW166.25 g/mol
LogP2.35
Rot. Bonds

About 1H-pyrrol-2-amine;thiophene

1H-pyrrol-2-amine;thiophene (PubChem CID 174932440) has the molecular formula C8H10N2S and a molecular weight of 166.25 g/mol. Its IUPAC name is 1H-pyrrol-2-amine;thiophene.

Molecular Properties

Compound Name1H-pyrrol-2-amine;thiophene
PubChem CID174932440
Molecular FormulaC8H10N2S
Molecular Weight166.25 g/mol
Exact Mass166.06
IUPAC Name1H-pyrrol-2-amine;thiophene
SMILESNc1ccc[nH]1.c1ccsc1
InChIInChI=1S/C4H6N2.C4H4S/c5-4-2-1-3-6-4;1-2-4-5-3-1/h1-3,6H,5H2;1-4H
InChIKeyRXLCLRQNBGGIID-UHFFFAOYSA-N
XLogP2.35
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.25
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1H-pyrrol-2-amine;thiophene?
The IUPAC name of 1H-pyrrol-2-amine;thiophene (CID 174932440) is 1H-pyrrol-2-amine;thiophene.
What is the SMILES notation for 1H-pyrrol-2-amine;thiophene?
The canonical SMILES for 1H-pyrrol-2-amine;thiophene is Nc1ccc[nH]1.c1ccsc1.
What is the InChIKey of 1H-pyrrol-2-amine;thiophene?
The InChIKey is RXLCLRQNBGGIID-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2.C4H4S/c5-4-2-1-3-6-4;1-2-4-5-3-1/h1-3,6H,5H2;1-4H.
What are the key properties of 1H-pyrrol-2-amine;thiophene?
1H-pyrrol-2-amine;thiophene has a molecular weight of 166.25 g/mol, XLogP of 2.35, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-pyrrol-2-amine;thiophene is sourced from PubChem (CID 174932440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).