2-[(2-fluorophenyl)methyl]pyrrol-1-amine

C11H11FN2 — CID 19838770

IUPAC2-[(2-fluorophenyl)methyl]pyrrol-1-amine
SMILESNn1cccc1Cc1ccccc1F
InChIInChI=1S/C11H11FN2/c12-11-6-2-1-4-9(11)8-10-5-3-7-14(10)13/h1-7H,8,13H2
InChIKeyTYZMYECLKNNZOM-UHFFFAOYSA-N
MW190.22 g/mol
LogP1.93
Rot. Bonds2

About 2-[(2-fluorophenyl)methyl]pyrrol-1-amine

2-[(2-fluorophenyl)methyl]pyrrol-1-amine (PubChem CID 19838770) has the molecular formula C11H11FN2 and a molecular weight of 190.22 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)methyl]pyrrol-1-amine.

Molecular Properties

Compound Name2-[(2-fluorophenyl)methyl]pyrrol-1-amine
PubChem CID19838770
Molecular FormulaC11H11FN2
Molecular Weight190.22 g/mol
Exact Mass190.09
IUPAC Name2-[(2-fluorophenyl)methyl]pyrrol-1-amine
SMILESNn1cccc1Cc1ccccc1F
InChIInChI=1S/C11H11FN2/c12-11-6-2-1-4-9(11)8-10-5-3-7-14(10)13/h1-7H,8,13H2
InChIKeyTYZMYECLKNNZOM-UHFFFAOYSA-N
XLogP1.93
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.22
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-fluorophenyl)methyl]aniline
CID 21497428
4-[(2-fluorophenyl)methyl]-2-methylaniline
CID 134448573
2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine
CID 20642648
ethane;(2-fluorophenyl)methylhydrazine
CID 142817687
8-bromo-2-[(2-fluorophenyl)methyl]imidazo[1,2-a]pyridine
CID 117137365
3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117146975
2-[(2-fluorophenyl)methyl]imidazo[1,2-a]pyridine-8-carbaldehyde
CID 117137327
azane;1-fluoro-2-(fluoromethyl)benzene
CID 174977857
4-[(2-fluorophenyl)methyl]pyridine
CID 23294432
5-chloro-3-[(2-fluorophenyl)methyl]-2-methylaniline
CID 154647758
2-[7-[(2-fluorophenyl)methyl]imidazo[1,5-b]pyridazin-5-yl]pyrimidine-4,5,6-triamine
CID 70983209
5-fluoro-2-[(2-fluorophenyl)methyl]-6-methylpyrimidin-4-amine
CID 66000568

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)methyl]pyrrol-1-amine?
The IUPAC name of 2-[(2-fluorophenyl)methyl]pyrrol-1-amine (CID 19838770) is 2-[(2-fluorophenyl)methyl]pyrrol-1-amine.
What is the SMILES notation for 2-[(2-fluorophenyl)methyl]pyrrol-1-amine?
The canonical SMILES for 2-[(2-fluorophenyl)methyl]pyrrol-1-amine is Nn1cccc1Cc1ccccc1F.
What is the InChIKey of 2-[(2-fluorophenyl)methyl]pyrrol-1-amine?
The InChIKey is TYZMYECLKNNZOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2/c12-11-6-2-1-4-9(11)8-10-5-3-7-14(10)13/h1-7H,8,13H2.
What are the key properties of 2-[(2-fluorophenyl)methyl]pyrrol-1-amine?
2-[(2-fluorophenyl)methyl]pyrrol-1-amine has a molecular weight of 190.22 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)methyl]pyrrol-1-amine is sourced from PubChem (CID 19838770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).