5-(3-chlorophenyl)-1H-pyrrol-2-amine

C10H9ClN2 — CID 117222744

IUPAC5-(3-chlorophenyl)-1H-pyrrol-2-amine
SMILESNc1ccc(-c2cccc(Cl)c2)[nH]1
InChIInChI=1S/C10H9ClN2/c11-8-3-1-2-7(6-8)9-4-5-10(12)13-9/h1-6,13H,12H2
InChIKeyFKQOFRKKUZSUEJ-UHFFFAOYSA-N
MW192.65 g/mol
LogP2.92
Rot. Bonds1

About 5-(3-chlorophenyl)-1H-pyrrol-2-amine

5-(3-chlorophenyl)-1H-pyrrol-2-amine (PubChem CID 117222744) has the molecular formula C10H9ClN2 and a molecular weight of 192.65 g/mol. Its IUPAC name is 5-(3-chlorophenyl)-1H-pyrrol-2-amine.

Molecular Properties

Compound Name5-(3-chlorophenyl)-1H-pyrrol-2-amine
PubChem CID117222744
Molecular FormulaC10H9ClN2
Molecular Weight192.65 g/mol
Exact Mass192.05
IUPAC Name5-(3-chlorophenyl)-1H-pyrrol-2-amine
SMILESNc1ccc(-c2cccc(Cl)c2)[nH]1
InChIInChI=1S/C10H9ClN2/c11-8-3-1-2-7(6-8)9-4-5-10(12)13-9/h1-6,13H,12H2
InChIKeyFKQOFRKKUZSUEJ-UHFFFAOYSA-N
XLogP2.92
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.65
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

3-amino-6-(3-chlorophenyl)-1H-pyridin-2-one
CID 105476832
4-(3-chlorophenyl)-1H-pyrrol-2-amine
CID 117222858
6-(3-chlorophenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 166272958
2-chloro-5-(3-chlorophenyl)-1H-imidazole
CID 105466466
5-amino-3-(3-chlorophenyl)-2H-isoquinolin-1-one;hydrobromide
CID 90203147
4-chloro-6-(3-chlorophenyl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine
CID 134149549
3-(3-chlorophenyl)aniline;hydrochloride
CID 2757424
2-(3-chlorophenyl)-5-[dichloro(fluoro)methyl]sulfanyl-1H-pyrrole
CID 18949073
4-(3-chlorophenyl)benzene-1,2-diamine
CID 13007821
4-(aminomethyl)-6-(3-chlorophenyl)-1H-pyridin-2-one
CID 105495501
2-(3-chlorophenyl)-1H-imidazo[1,2-a]pyridin-5-one
CID 117133007
5-(4-fluorophenyl)-1H-pyrrol-2-amine
CID 117223095

Frequently Asked Questions

What is the IUPAC name of 5-(3-chlorophenyl)-1H-pyrrol-2-amine?
The IUPAC name of 5-(3-chlorophenyl)-1H-pyrrol-2-amine (CID 117222744) is 5-(3-chlorophenyl)-1H-pyrrol-2-amine.
What is the SMILES notation for 5-(3-chlorophenyl)-1H-pyrrol-2-amine?
The canonical SMILES for 5-(3-chlorophenyl)-1H-pyrrol-2-amine is Nc1ccc(-c2cccc(Cl)c2)[nH]1.
What is the InChIKey of 5-(3-chlorophenyl)-1H-pyrrol-2-amine?
The InChIKey is FKQOFRKKUZSUEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2/c11-8-3-1-2-7(6-8)9-4-5-10(12)13-9/h1-6,13H,12H2.
What are the key properties of 5-(3-chlorophenyl)-1H-pyrrol-2-amine?
5-(3-chlorophenyl)-1H-pyrrol-2-amine has a molecular weight of 192.65 g/mol, XLogP of 2.92, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-chlorophenyl)-1H-pyrrol-2-amine is sourced from PubChem (CID 117222744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).