5-(4-fluorophenyl)-1H-pyrrol-2-amine

C10H9FN2 — CID 117223095

IUPAC5-(4-fluorophenyl)-1H-pyrrol-2-amine
SMILESNc1ccc(-c2ccc(F)cc2)[nH]1
InChIInChI=1S/C10H9FN2/c11-8-3-1-7(2-4-8)9-5-6-10(12)13-9/h1-6,13H,12H2
InChIKeyINRMHJBNLUHNJZ-UHFFFAOYSA-N
MW176.19 g/mol
LogP2.40
Rot. Bonds1

About 5-(4-fluorophenyl)-1H-pyrrol-2-amine

5-(4-fluorophenyl)-1H-pyrrol-2-amine (PubChem CID 117223095) has the molecular formula C10H9FN2 and a molecular weight of 176.19 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-1H-pyrrol-2-amine.

Molecular Properties

Compound Name5-(4-fluorophenyl)-1H-pyrrol-2-amine
PubChem CID117223095
Molecular FormulaC10H9FN2
Molecular Weight176.19 g/mol
Exact Mass176.07
IUPAC Name5-(4-fluorophenyl)-1H-pyrrol-2-amine
SMILESNc1ccc(-c2ccc(F)cc2)[nH]1
InChIInChI=1S/C10H9FN2/c11-8-3-1-7(2-4-8)9-5-6-10(12)13-9/h1-6,13H,12H2
InChIKeyINRMHJBNLUHNJZ-UHFFFAOYSA-N
XLogP2.40
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.19
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethenyl-5-(4-fluorophenyl)-1H-pyrrole
CID 167028653
7-fluoro-2-(4-fluorophenyl)-1H-indol-4-amine
CID 82385922
1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 58320925
5-(3-chlorophenyl)-1H-pyrrol-2-amine
CID 117222744
4,5-bis(4-fluorophenyl)benzene-1,2-diamine
CID 135324537
6-(4-fluorophenyl)-2-sulfanylidene-1H-pyridine-3-carbothioamide
CID 82122412
4-(6-fluoro-1H-indol-2-yl)aniline
CID 71602423
2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-amine
CID 86727993
6-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carbaldehyde
CID 82519690
2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-amine;hydrochloride
CID 86728040
5-fluoro-2-(4-fluorophenyl)aniline
CID 46312178
6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one
CID 82519671

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-1H-pyrrol-2-amine?
The IUPAC name of 5-(4-fluorophenyl)-1H-pyrrol-2-amine (CID 117223095) is 5-(4-fluorophenyl)-1H-pyrrol-2-amine.
What is the SMILES notation for 5-(4-fluorophenyl)-1H-pyrrol-2-amine?
The canonical SMILES for 5-(4-fluorophenyl)-1H-pyrrol-2-amine is Nc1ccc(-c2ccc(F)cc2)[nH]1.
What is the InChIKey of 5-(4-fluorophenyl)-1H-pyrrol-2-amine?
The InChIKey is INRMHJBNLUHNJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2/c11-8-3-1-7(2-4-8)9-5-6-10(12)13-9/h1-6,13H,12H2.
What are the key properties of 5-(4-fluorophenyl)-1H-pyrrol-2-amine?
5-(4-fluorophenyl)-1H-pyrrol-2-amine has a molecular weight of 176.19 g/mol, XLogP of 2.40, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-1H-pyrrol-2-amine is sourced from PubChem (CID 117223095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).