1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol

C14H20FNO — CID 113262785

IUPAC1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol
SMILESCCC(O)CCNC1CCc2c(F)cccc21
InChIInChI=1S/C14H20FNO/c1-2-10(17)8-9-16-14-7-6-11-12(14)4-3-5-13(11)15/h3-5,10,14,16-17H,2,6-9H2,1H3
InChIKeyDNIHIJVXFPJJKS-UHFFFAOYSA-N
MW237.32 g/mol
LogP2.56
Rot. Bonds5

About 1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol

1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol (PubChem CID 113262785) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol.

Molecular Properties

Compound Name1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol
PubChem CID113262785
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol
SMILESCCC(O)CCNC1CCc2c(F)cccc21
InChIInChI=1S/C14H20FNO/c1-2-10(17)8-9-16-14-7-6-11-12(14)4-3-5-13(11)15/h3-5,10,14,16-17H,2,6-9H2,1H3
InChIKeyDNIHIJVXFPJJKS-UHFFFAOYSA-N
XLogP2.56
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol with MolForge

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Related Compounds

4-fluoro-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 61383392
1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]-3-methoxypropan-2-ol
CID 81338280
N-(2-butoxyethyl)-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 79484036
4-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]-3-methylbutan-1-ol
CID 81343552
4-fluoro-N-(3-propoxypropyl)-2,3-dihydro-1H-inden-1-amine
CID 83065403
1,1,1-trifluoro-3-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]propan-2-ol
CID 113260457
4-fluoro-N-(3-methyl-2-propan-2-ylbutyl)-2,3-dihydro-1H-inden-1-amine
CID 102904112
4-fluoro-N-(2-phenylethyl)-2,3-dihydro-1H-inden-1-amine
CID 79483582
1-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ylamino)pentan-3-ol
CID 113262793
N-[(4-ethylcyclohexyl)methyl]-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 83065498
4-fluoro-N-(3-methylpentan-2-yl)-2,3-dihydro-1H-inden-1-amine
CID 79492992
2-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]ethyl carbamate
CID 83209258

Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol?
The IUPAC name of 1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol (CID 113262785) is 1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol.
What is the SMILES notation for 1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol?
The canonical SMILES for 1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol is CCC(O)CCNC1CCc2c(F)cccc21.
What is the InChIKey of 1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol?
The InChIKey is DNIHIJVXFPJJKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-2-10(17)8-9-16-14-7-6-11-12(14)4-3-5-13(11)15/h3-5,10,14,16-17H,2,6-9H2,1H3.
What are the key properties of 1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol?
1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol has a molecular weight of 237.32 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentan-3-ol is sourced from PubChem (CID 113262785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).