5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine

C17H27FN2 — CID 103503185

IUPAC5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine
SMILESCC(C)CNCCCCCN1CCc2ccc(F)cc21
InChIInChI=1S/C17H27FN2/c1-14(2)13-19-9-4-3-5-10-20-11-8-15-6-7-16(18)12-17(15)20/h6-7,12,14,19H,3-5,8-11,13H2,1-2H3
InChIKeyZQDHYNJIKNVYSP-UHFFFAOYSA-N
MW278.42 g/mol
LogP3.60
Rot. Bonds8

About 5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine

5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine (PubChem CID 103503185) has the molecular formula C17H27FN2 and a molecular weight of 278.42 g/mol. Its IUPAC name is 5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine.

Molecular Properties

Compound Name5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine
PubChem CID103503185
Molecular FormulaC17H27FN2
Molecular Weight278.42 g/mol
Exact Mass278.22
IUPAC Name5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine
SMILESCC(C)CNCCCCCN1CCc2ccc(F)cc21
InChIInChI=1S/C17H27FN2/c1-14(2)13-19-9-4-3-5-10-20-11-8-15-6-7-16(18)12-17(15)20/h6-7,12,14,19H,3-5,8-11,13H2,1-2H3
InChIKeyZQDHYNJIKNVYSP-UHFFFAOYSA-N
XLogP3.60
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-(6-fluoro-2,3-dihydroindol-1-yl)-N-methylpentan-1-amine
CID 103503121
4-(6-fluoro-2,3-dihydroindol-1-yl)-N-methylbutan-1-amine
CID 103497056
N-ethyl-3-(6-fluoro-2,3-dihydroindol-1-yl)propan-1-amine
CID 103494949
N-[2-(6-fluoro-2,3-dihydroindol-1-yl)ethyl]-3-methylbutan-1-amine
CID 103503406
4-(6-fluoro-2,3-dihydroindol-1-yl)butane-1-thiol
CID 103504365
4-(6-fluoro-2,3-dihydroindol-1-yl)-N-propylbutan-2-amine
CID 103494946
6-(6-fluoro-2,3-dihydroindol-1-yl)hexan-3-one
CID 106801628
N-ethyl-6-(6-fluoro-2,3-dihydroindol-1-yl)hexan-3-amine
CID 106800163
4-(6-fluoro-2,3-dihydroindol-1-yl)butanehydrazide
CID 103503791
3-(6-fluoro-2,3-dihydroindol-1-yl)-N-methylpropanamide
CID 130269379
4-(6-fluoro-2,3-dihydroindol-1-yl)-2-(propan-2-ylamino)butanoic acid
CID 103501927
6-(6-fluoro-2,3-dihydroindol-1-yl)-2-methyl-2-(methylamino)hexan-1-ol
CID 103503977

Frequently Asked Questions

What is the IUPAC name of 5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine?
The IUPAC name of 5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine (CID 103503185) is 5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine.
What is the SMILES notation for 5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine?
The canonical SMILES for 5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine is CC(C)CNCCCCCN1CCc2ccc(F)cc21.
What is the InChIKey of 5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine?
The InChIKey is ZQDHYNJIKNVYSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27FN2/c1-14(2)13-19-9-4-3-5-10-20-11-8-15-6-7-16(18)12-17(15)20/h6-7,12,14,19H,3-5,8-11,13H2,1-2H3.
What are the key properties of 5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine?
5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine has a molecular weight of 278.42 g/mol, XLogP of 3.60, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-fluoro-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pentan-1-amine is sourced from PubChem (CID 103503185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).