2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine

C16H20FNO — CID 103905870

IUPAC2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine
SMILESFc1ccc2c(c1)CCC2NC1CCOC1C1CC1
InChIInChI=1S/C16H20FNO/c17-12-4-5-13-11(9-12)3-6-14(13)18-15-7-8-19-16(15)10-1-2-10/h4-5,9-10,14-16,18H,1-3,6-8H2
InChIKeyPHDGOYHBESECMV-UHFFFAOYSA-N
MW261.34 g/mol
LogP2.97
Rot. Bonds3

About 2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine

2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine (PubChem CID 103905870) has the molecular formula C16H20FNO and a molecular weight of 261.34 g/mol. Its IUPAC name is 2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine
PubChem CID103905870
Molecular FormulaC16H20FNO
Molecular Weight261.34 g/mol
Exact Mass261.15
IUPAC Name2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine
SMILESFc1ccc2c(c1)CCC2NC1CCOC1C1CC1
InChIInChI=1S/C16H20FNO/c17-12-4-5-13-11(9-12)3-6-14(13)18-15-7-8-19-16(15)10-1-2-10/h4-5,9-10,14-16,18H,1-3,6-8H2
InChIKeyPHDGOYHBESECMV-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.34
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-N-[1-(2,6-difluorophenyl)ethyl]oxolan-3-amine
CID 103905858
2-cyclopropyl-N-[1-(2,4-difluorophenyl)ethyl]oxolan-3-amine
CID 103905871
N-[1-(2-fluorophenyl)cyclopropyl]-2-methyloxolan-3-amine
CID 75516837
(2R)-4-(3,5-difluorophenyl)-1-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]butan-2-ol
CID 68608195
(2R)-4-(3,5-difluorophenyl)-1-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]butan-2-ol
CID 68608558
N-[cyclopropyl-(4-fluorophenyl)methyl]-2-(oxolan-2-yl)ethanamine
CID 54917460
1-(5-fluoro-2-methylphenyl)-N-methyl-2-(oxolan-2-yl)ethanamine
CID 55094104
N-[1-(5-fluoro-2-methylphenyl)-2-(oxolan-2-yl)ethyl]propan-1-amine
CID 55094201
N-[1-(4-fluoro-2-methylphenyl)-2-(oxolan-2-yl)ethyl]propan-1-amine
CID 55115903
N-[2-(2,2,2-trifluoroethoxy)ethyl]-2,3-dihydro-1H-inden-1-amine
CID 55151518
N-propyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]-2,3-dihydro-1H-inden-1-amine
CID 61748454
N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]-2,3-dihydro-1H-inden-1-amine
CID 61749458

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine?
The IUPAC name of 2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine (CID 103905870) is 2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine.
What is the SMILES notation for 2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine?
The canonical SMILES for 2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine is Fc1ccc2c(c1)CCC2NC1CCOC1C1CC1.
What is the InChIKey of 2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine?
The InChIKey is PHDGOYHBESECMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FNO/c17-12-4-5-13-11(9-12)3-6-14(13)18-15-7-8-19-16(15)10-1-2-10/h4-5,9-10,14-16,18H,1-3,6-8H2.
What are the key properties of 2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine?
2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine has a molecular weight of 261.34 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)oxolan-3-amine is sourced from PubChem (CID 103905870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).