N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine

C11H13FN2 — CID 117180302

IUPACN-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine
SMILESCCNCc1cc2ccc(F)cc2[nH]1
InChIInChI=1S/C11H13FN2/c1-2-13-7-10-5-8-3-4-9(12)6-11(8)14-10/h3-6,13-14H,2,7H2,1H3
InChIKeyRWNOFJIUKWHDSP-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.42
Rot. Bonds3

About N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine

N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine (PubChem CID 117180302) has the molecular formula C11H13FN2 and a molecular weight of 192.24 g/mol. Its IUPAC name is N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine
PubChem CID117180302
Molecular FormulaC11H13FN2
Molecular Weight192.24 g/mol
Exact Mass192.11
IUPAC NameN-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine
SMILESCCNCc1cc2ccc(F)cc2[nH]1
InChIInChI=1S/C11H13FN2/c1-2-13-7-10-5-8-3-4-9(12)6-11(8)14-10/h3-6,13-14H,2,7H2,1H3
InChIKeyRWNOFJIUKWHDSP-UHFFFAOYSA-N
XLogP2.42
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(6-chloro-1H-indol-2-yl)methyl]ethanamine
CID 117180309
N-[(6-fluoro-1H-indol-2-yl)methyl]cyclopentanamine
CID 117180030
(6-fluoro-1H-indol-2-yl)methanol;methyl 6-fluoro-1H-indole-2-carboxylate
CID 165084433
1-(5-fluoro-1H-indol-2-yl)-N-methylmethanamine;methanesulfonic acid
CID 53398780
2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol
CID 117180167
N-[(4-fluorophenyl)methyl]ethanamine
CID 4716481
3-(6-fluoro-1H-indol-2-yl)propyl methanesulfonate
CID 22735785
N-[[3-(2,5-difluorophenyl)-1H-pyrazol-5-yl]methyl]ethanamine
CID 62112347
N-(1H-indol-2-ylmethyl)-2-methylbutan-1-amine
CID 115763447
N-[(2,5-difluorophenyl)methyl]ethanamine
CID 43163700
3-[(6-fluoro-1H-indol-2-yl)methyl]-6-methylpiperazine-2,5-dione
CID 162655603
N-ethyl-2-(6-fluoro-1H-benzimidazol-2-yl)ethanamine
CID 25218862

Frequently Asked Questions

What is the IUPAC name of N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine?
The IUPAC name of N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine (CID 117180302) is N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine.
What is the SMILES notation for N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine?
The canonical SMILES for N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine is CCNCc1cc2ccc(F)cc2[nH]1.
What is the InChIKey of N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine?
The InChIKey is RWNOFJIUKWHDSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2/c1-2-13-7-10-5-8-3-4-9(12)6-11(8)14-10/h3-6,13-14H,2,7H2,1H3.
What are the key properties of N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine?
N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine has a molecular weight of 192.24 g/mol, XLogP of 2.42, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-fluoro-1H-indol-2-yl)methyl]ethanamine is sourced from PubChem (CID 117180302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).