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

C12H13FN2 — CID 105456230

IUPAC(5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine
SMILESNCC1Cc2cc3c(F)cccc3n2C1
InChIInChI=1S/C12H13FN2/c13-11-2-1-3-12-10(11)5-9-4-8(6-14)7-15(9)12/h1-3,5,8H,4,6-7,14H2
InChIKeyZRICTCCYZRQQOY-UHFFFAOYSA-N
MW204.25 g/mol
LogP1.91
Rot. Bonds1

About (5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine

(5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine (PubChem CID 105456230) has the molecular formula C12H13FN2 and a molecular weight of 204.25 g/mol. Its IUPAC name is (5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine.

Molecular Properties

Compound Name(5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine
PubChem CID105456230
Molecular FormulaC12H13FN2
Molecular Weight204.25 g/mol
Exact Mass204.11
IUPAC Name(5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine
SMILESNCC1Cc2cc3c(F)cccc3n2C1
InChIInChI=1S/C12H13FN2/c13-11-2-1-3-12-10(11)5-9-4-8(6-14)7-15(9)12/h1-3,5,8H,4,6-7,14H2
InChIKeyZRICTCCYZRQQOY-UHFFFAOYSA-N
XLogP1.91
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 ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1-fluoro-6,7,8,9-tetrahydropyrido[1,2-a]indol-8-yl)methanamine
CID 105472592
2-(aminomethyl)-2,3-dihydro-1H-pyrrolo[1,2-a]indol-5-ol
CID 105454422
5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indole-2-carboxylic acid
CID 105473568
8-(aminomethyl)-6,7,8,9-tetrahydropyrido[1,2-a]indol-1-ol
CID 105469892
(1-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indol-8-yl)methanamine
CID 105468047
(1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-7-yl)methanamine
CID 105488420
1-fluoro-6,7,8,9-tetrahydropyrido[1,2-a]indol-9-amine
CID 105456213
1-chloro-6,7,8,9-tetrahydropyrido[1,2-a]indol-8-amine
CID 105476885
[(2R)-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl]methanol
CID 10583749
[1-[(2,6-difluorophenyl)methyl]pyrrolidin-3-yl]methanamine
CID 62069119
(1-fluoro-6,7,8,9,9a,10-hexahydropyrido[1,2-a]indol-8-yl)methanamine
CID 105475993
1-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-8-amine
CID 105469893

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine?
The IUPAC name of (5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine (CID 105456230) is (5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine.
What is the SMILES notation for (5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine?
The canonical SMILES for (5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine is NCC1Cc2cc3c(F)cccc3n2C1.
What is the InChIKey of (5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine?
The InChIKey is ZRICTCCYZRQQOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN2/c13-11-2-1-3-12-10(11)5-9-4-8(6-14)7-15(9)12/h1-3,5,8H,4,6-7,14H2.
What are the key properties of (5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine?
(5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine has a molecular weight of 204.25 g/mol, XLogP of 1.91, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-yl)methanamine is sourced from PubChem (CID 105456230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).