2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine

C18H27FN2 — CID 103502594

IUPAC2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine
SMILESCCCC1CCC(N)C(CN2CCc3ccc(F)cc32)C1
InChIInChI=1S/C18H27FN2/c1-2-3-13-4-7-17(20)15(10-13)12-21-9-8-14-5-6-16(19)11-18(14)21/h5-6,11,13,15,17H,2-4,7-10,12,20H2,1H3
InChIKeyZHESYJYWRWNGDH-UHFFFAOYSA-N
MW290.43 g/mol
LogP3.73
Rot. Bonds4

About 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine

2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine (PubChem CID 103502594) has the molecular formula C18H27FN2 and a molecular weight of 290.43 g/mol. Its IUPAC name is 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine.

Molecular Properties

Compound Name2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine
PubChem CID103502594
Molecular FormulaC18H27FN2
Molecular Weight290.43 g/mol
Exact Mass290.22
IUPAC Name2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine
SMILESCCCC1CCC(N)C(CN2CCc3ccc(F)cc32)C1
InChIInChI=1S/C18H27FN2/c1-2-3-13-4-7-17(20)15(10-13)12-21-9-8-14-5-6-16(19)11-18(14)21/h5-6,11,13,15,17H,2-4,7-10,12,20H2,1H3
InChIKeyZHESYJYWRWNGDH-UHFFFAOYSA-N
XLogP3.73
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.43
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 103502585
2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine
CID 103497070
4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine
CID 103497186
2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-propylcyclohexan-1-amine
CID 62615711
1-[(2-amino-5-propylcyclohexyl)methyl]pyrrolidine-3,4-diol
CID 106674036
1-cyclopentyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494909
[1-(cyclopropylmethyl)-2,3-dihydroindol-6-yl]methanamine
CID 115105775
methyl 3-(6-fluoro-2,3-dihydroindol-1-yl)-2-methylpropanoate
CID 103497970
(E)-4-(6-fluoro-2,3-dihydroindol-1-yl)but-2-en-1-amine
CID 103495908
1-[(4-bromophenyl)methyl]-6-fluoro-2,3-dihydroindole
CID 103501587
N-ethyl-3-(6-fluoro-2,3-dihydroindol-1-yl)propan-1-amine
CID 103494949
1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2,3-dihydroindol-6-amine
CID 66363550

Frequently Asked Questions

What is the IUPAC name of 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine?
The IUPAC name of 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine (CID 103502594) is 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine.
What is the SMILES notation for 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine?
The canonical SMILES for 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine is CCCC1CCC(N)C(CN2CCc3ccc(F)cc32)C1.
What is the InChIKey of 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine?
The InChIKey is ZHESYJYWRWNGDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27FN2/c1-2-3-13-4-7-17(20)15(10-13)12-21-9-8-14-5-6-16(19)11-18(14)21/h5-6,11,13,15,17H,2-4,7-10,12,20H2,1H3.
What are the key properties of 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine?
2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine has a molecular weight of 290.43 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine is sourced from PubChem (CID 103502594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).