1-(3-fluoropropyl)-5-propan-2-yloxyindole

C14H18FNO — CID 116625898

IUPAC1-(3-fluoropropyl)-5-propan-2-yloxyindole
SMILESCC(C)Oc1ccc2c(ccn2CCCF)c1
InChIInChI=1S/C14H18FNO/c1-11(2)17-13-4-5-14-12(10-13)6-9-16(14)8-3-7-15/h4-6,9-11H,3,7-8H2,1-2H3
InChIKeyQIXVSEHWCNYGAH-UHFFFAOYSA-N
MW235.30 g/mol
LogP3.79
Rot. Bonds5

About 1-(3-fluoropropyl)-5-propan-2-yloxyindole

1-(3-fluoropropyl)-5-propan-2-yloxyindole (PubChem CID 116625898) has the molecular formula C14H18FNO and a molecular weight of 235.30 g/mol. Its IUPAC name is 1-(3-fluoropropyl)-5-propan-2-yloxyindole.

Molecular Properties

Compound Name1-(3-fluoropropyl)-5-propan-2-yloxyindole
PubChem CID116625898
Molecular FormulaC14H18FNO
Molecular Weight235.30 g/mol
Exact Mass235.14
IUPAC Name1-(3-fluoropropyl)-5-propan-2-yloxyindole
SMILESCC(C)Oc1ccc2c(ccn2CCCF)c1
InChIInChI=1S/C14H18FNO/c1-11(2)17-13-4-5-14-12(10-13)6-9-16(14)8-3-7-15/h4-6,9-11H,3,7-8H2,1-2H3
InChIKeyQIXVSEHWCNYGAH-UHFFFAOYSA-N
XLogP3.79
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(5-propan-2-yloxyindol-1-yl)butan-1-amine
CID 80643163
1-(3-ethoxypropyl)-5-propan-2-yloxyindole
CID 116625752
1-(2-methoxyethyl)-5-propan-2-yloxyindole
CID 116625827
5-propan-2-yloxy-1-(2-propoxyethyl)indole
CID 106458095
1-(2-piperidin-1-ylethyl)-5-propan-2-yloxyindole
CID 116625738
N-propan-2-yl-3-(5-propan-2-yloxyindol-1-yl)propanamide
CID 116625781
5-propan-2-yloxy-1-prop-2-ynylindole
CID 116625801
1-(2,2-diethoxyethyl)-5-propan-2-yloxyindole
CID 80649265
1-(cyclopentylmethyl)-5-propan-2-yloxyindole
CID 116625784
1-[(5-ethylthiophen-2-yl)methyl]-5-propan-2-yloxyindole
CID 116625768
3-methyl-1-(5-propan-2-yloxyindol-1-yl)pentan-2-one
CID 80643678
N,N-dimethyl-1-[(5-propan-2-yloxyindol-1-yl)methyl]cyclopropan-1-amine
CID 162388983

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoropropyl)-5-propan-2-yloxyindole?
The IUPAC name of 1-(3-fluoropropyl)-5-propan-2-yloxyindole (CID 116625898) is 1-(3-fluoropropyl)-5-propan-2-yloxyindole.
What is the SMILES notation for 1-(3-fluoropropyl)-5-propan-2-yloxyindole?
The canonical SMILES for 1-(3-fluoropropyl)-5-propan-2-yloxyindole is CC(C)Oc1ccc2c(ccn2CCCF)c1.
What is the InChIKey of 1-(3-fluoropropyl)-5-propan-2-yloxyindole?
The InChIKey is QIXVSEHWCNYGAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO/c1-11(2)17-13-4-5-14-12(10-13)6-9-16(14)8-3-7-15/h4-6,9-11H,3,7-8H2,1-2H3.
What are the key properties of 1-(3-fluoropropyl)-5-propan-2-yloxyindole?
1-(3-fluoropropyl)-5-propan-2-yloxyindole has a molecular weight of 235.30 g/mol, XLogP of 3.79, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoropropyl)-5-propan-2-yloxyindole is sourced from PubChem (CID 116625898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).