2-fluoro-5-(oxolan-2-yl)pentan-1-amine

C9H18FNO — CID 112562582

IUPAC2-fluoro-5-(oxolan-2-yl)pentan-1-amine
SMILESNCC(F)CCCC1CCCO1
InChIInChI=1S/C9H18FNO/c10-8(7-11)3-1-4-9-5-2-6-12-9/h8-9H,1-7,11H2
InChIKeyFPELWQVDRNWTDH-UHFFFAOYSA-N
MW175.25 g/mol
LogP1.63
Rot. Bonds5

About 2-fluoro-5-(oxolan-2-yl)pentan-1-amine

2-fluoro-5-(oxolan-2-yl)pentan-1-amine (PubChem CID 112562582) has the molecular formula C9H18FNO and a molecular weight of 175.25 g/mol. Its IUPAC name is 2-fluoro-5-(oxolan-2-yl)pentan-1-amine.

Molecular Properties

Compound Name2-fluoro-5-(oxolan-2-yl)pentan-1-amine
PubChem CID112562582
Molecular FormulaC9H18FNO
Molecular Weight175.25 g/mol
Exact Mass175.14
IUPAC Name2-fluoro-5-(oxolan-2-yl)pentan-1-amine
SMILESNCC(F)CCCC1CCCO1
InChIInChI=1S/C9H18FNO/c10-8(7-11)3-1-4-9-5-2-6-12-9/h8-9H,1-7,11H2
InChIKeyFPELWQVDRNWTDH-UHFFFAOYSA-N
XLogP1.63
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.25
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(Oxolan-2-yl)propan-1-amine
CID 22170041
4-(Tetrahydrofuran-2-yl)butan-1-amine
CID 22407280
5-(Oxolan-2-yl)pentan-1-amine
CID 58527505
3-[(2R)-oxolan-2-yl]propan-1-amine hydrochloride
CID 137935332
3-((2S)-oxolan-2-yl)propan-1-amine hydrochloride
CID 137935467
Tetrahydro-5-methyl-2-furanpropanamine
CID 55289661
4,4,4-Trifluoro-1-(oxolan-2-yl)butan-2-amine
CID 62604262
5,5,5-Trifluoro-1-(oxolan-2-yl)pentan-2-amine
CID 64567828
1,1,1-Trifluoro-6-(oxolan-2-yl)hexan-3-amine
CID 65164238
1,1,1-Trifluoro-5-(oxolan-2-yl)pentan-3-amine
CID 65164286
6,6,6-Trifluoro-1-(oxolan-2-yl)hexan-3-amine
CID 79953156
1,1,1-Trifluoro-7-(oxolan-2-yl)heptan-4-amine
CID 79953752

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-(oxolan-2-yl)pentan-1-amine?
The IUPAC name of 2-fluoro-5-(oxolan-2-yl)pentan-1-amine (CID 112562582) is 2-fluoro-5-(oxolan-2-yl)pentan-1-amine.
What is the SMILES notation for 2-fluoro-5-(oxolan-2-yl)pentan-1-amine?
The canonical SMILES for 2-fluoro-5-(oxolan-2-yl)pentan-1-amine is NCC(F)CCCC1CCCO1.
What is the InChIKey of 2-fluoro-5-(oxolan-2-yl)pentan-1-amine?
The InChIKey is FPELWQVDRNWTDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18FNO/c10-8(7-11)3-1-4-9-5-2-6-12-9/h8-9H,1-7,11H2.
What are the key properties of 2-fluoro-5-(oxolan-2-yl)pentan-1-amine?
2-fluoro-5-(oxolan-2-yl)pentan-1-amine has a molecular weight of 175.25 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-(oxolan-2-yl)pentan-1-amine is sourced from PubChem (CID 112562582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).