(7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine

C12H13FN2 — CID 105456235

IUPAC(7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine
SMILESNCC1CCn2c1cc1ccc(F)cc12
InChIInChI=1S/C12H13FN2/c13-10-2-1-8-5-11-9(7-14)3-4-15(11)12(8)6-10/h1-2,5-6,9H,3-4,7,14H2
InChIKeySOJKVDIVGVKBLO-UHFFFAOYSA-N
MW204.25 g/mol
LogP2.23
Rot. Bonds1

About (7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine

(7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine (PubChem CID 105456235) has the molecular formula C12H13FN2 and a molecular weight of 204.25 g/mol. Its IUPAC name is (7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine.

Molecular Properties

Compound Name(7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine
PubChem CID105456235
Molecular FormulaC12H13FN2
Molecular Weight204.25 g/mol
Exact Mass204.11
IUPAC Name(7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine
SMILESNCC1CCn2c1cc1ccc(F)cc12
InChIInChI=1S/C12H13FN2/c13-10-2-1-8-5-11-9(7-14)3-4-15(11)12(8)6-10/h1-2,5-6,9H,3-4,7,14H2
InChIKeySOJKVDIVGVKBLO-UHFFFAOYSA-N
XLogP2.23
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.25
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-methoxy-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine
CID 105469922
(6-fluoro-2,3-dihydro-1H-inden-1-yl)methanamine
CID 82074741
9-amino-6,7,8,9-tetrahydropyrido[1,2-a]indol-3-ol
CID 105454412
(6-fluoro-1-methyl-2,3-dihydroindol-3-yl)methanamine
CID 82277185
4-(aminomethyl)-7-fluoro-3,4-dihydro-2H-naphthalen-1-one
CID 82505065
[(7S)-4-fluoro-7-bicyclo[4.2.0]octa-1(6),2,4-trienyl]methanamine
CID 98041428
3-(aminomethyl)-1-(4-fluorophenyl)piperidin-2-one
CID 83642502
2-fluoro-6,7,8,9-tetrahydropyrido[1,2-a]indol-8-amine
CID 105456218
(7-fluoro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)methanamine
CID 82241121
2-(7-fluoro-2-methoxy-1-oxo-3H-imidazo[1,5-a]indol-3-yl)acetic acid
CID 175170640
2-(6-chloropyridazin-4-yl)-1-cyclopropyl-6-fluoroindole
CID 135188071
6-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)hexan-1-amine
CID 62378467

Frequently Asked Questions

What is the IUPAC name of (7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine?
The IUPAC name of (7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine (CID 105456235) is (7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine.
What is the SMILES notation for (7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine?
The canonical SMILES for (7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine is NCC1CCn2c1cc1ccc(F)cc12.
What is the InChIKey of (7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine?
The InChIKey is SOJKVDIVGVKBLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN2/c13-10-2-1-8-5-11-9(7-14)3-4-15(11)12(8)6-10/h1-2,5-6,9H,3-4,7,14H2.
What are the key properties of (7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine?
(7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine has a molecular weight of 204.25 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)methanamine is sourced from PubChem (CID 105456235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).