2-(1H-pyrrol-2-yl)ethanamine

C6H10N2 — CID 13437360

IUPAC2-(1H-pyrrol-2-yl)ethanamine
SMILESNCCc1ccc[nH]1
InChIInChI=1S/C6H10N2/c7-4-3-6-2-1-5-8-6/h1-2,5,8H,3-4,7H2
InChIKeyIAZZNTYMXXEHHT-UHFFFAOYSA-N
MW110.16 g/mol
LogP0.52
Rot. Bonds2

About 2-(1H-pyrrol-2-yl)ethanamine

2-(1H-pyrrol-2-yl)ethanamine (PubChem CID 13437360) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 2-(1H-pyrrol-2-yl)ethanamine.

Molecular Properties

Compound Name2-(1H-pyrrol-2-yl)ethanamine
PubChem CID13437360
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name2-(1H-pyrrol-2-yl)ethanamine
SMILESNCCc1ccc[nH]1
InChIInChI=1S/C6H10N2/c7-4-3-6-2-1-5-8-6/h1-2,5,8H,3-4,7H2
InChIKeyIAZZNTYMXXEHHT-UHFFFAOYSA-N
XLogP0.52
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

Betahistine
CID 2366
2-Pyridineethanamine
CID 75919
2,5-Dimethylpyrrole
CID 12265
2-Pyridinemethanamine
CID 19509
2-(2-Pyrrolidinoethyl)pyridine
CID 238317
Betahistine Hydrochloride
CID 68643
Pyridine, 2-(2-(methylamino)ethyl)-, hydrochloride
CID 203875
2-Methylpyrrole
CID 12489
N-methyl-1-(pyridin-2-yl)methanamine
CID 88757
2,4-Dimethylpyrrole
CID 39539
2-Phenylpyrrole
CID 72898
4,5,6,7-Tetrahydroindole
CID 97429

Frequently Asked Questions

What is the IUPAC name of 2-(1H-pyrrol-2-yl)ethanamine?
The IUPAC name of 2-(1H-pyrrol-2-yl)ethanamine (CID 13437360) is 2-(1H-pyrrol-2-yl)ethanamine.
What is the SMILES notation for 2-(1H-pyrrol-2-yl)ethanamine?
The canonical SMILES for 2-(1H-pyrrol-2-yl)ethanamine is NCCc1ccc[nH]1.
What is the InChIKey of 2-(1H-pyrrol-2-yl)ethanamine?
The InChIKey is IAZZNTYMXXEHHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c7-4-3-6-2-1-5-8-6/h1-2,5,8H,3-4,7H2.
What are the key properties of 2-(1H-pyrrol-2-yl)ethanamine?
2-(1H-pyrrol-2-yl)ethanamine has a molecular weight of 110.16 g/mol, XLogP of 0.52, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-pyrrol-2-yl)ethanamine is sourced from PubChem (CID 13437360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).