4-(2-fluoroethoxy)pentan-2-amine

C7H16FNO — CID 87578557

IUPAC4-(2-fluoroethoxy)pentan-2-amine
SMILESCC(N)CC(C)OCCF
InChIInChI=1S/C7H16FNO/c1-6(9)5-7(2)10-4-3-8/h6-7H,3-5,9H2,1-2H3
InChIKeyRWSVITJYNREAKQ-UHFFFAOYSA-N
MW149.21 g/mol
LogP1.10
Rot. Bonds5

About 4-(2-fluoroethoxy)pentan-2-amine

4-(2-fluoroethoxy)pentan-2-amine (PubChem CID 87578557) has the molecular formula C7H16FNO and a molecular weight of 149.21 g/mol. Its IUPAC name is 4-(2-fluoroethoxy)pentan-2-amine.

Molecular Properties

Compound Name4-(2-fluoroethoxy)pentan-2-amine
PubChem CID87578557
Molecular FormulaC7H16FNO
Molecular Weight149.21 g/mol
Exact Mass149.12
IUPAC Name4-(2-fluoroethoxy)pentan-2-amine
SMILESCC(N)CC(C)OCCF
InChIInChI=1S/C7H16FNO/c1-6(9)5-7(2)10-4-3-8/h6-7H,3-5,9H2,1-2H3
InChIKeyRWSVITJYNREAKQ-UHFFFAOYSA-N
XLogP1.10
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.21
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1r,3r)-3-(2-Fluoroethoxy)cyclobutan-1-amine
CID 80696590
(2S)-1,1,1,5,5,5-hexafluoro-4-methoxypentan-2-amine
CID 164536517
1,1,1,5,5,5-Hexafluoro-4-methoxypentan-2-amine
CID 167116988
(3R)-1-(1-fluorocyclopropyl)oxypentan-3-amine
CID 168263675
4,4,4-Trifluoro-3-pentoxybutan-1-amine
CID 43753353
4-(2,2,2-Trifluoroethoxy)pentan-2-amine
CID 64706453
5-(1,1,1-Trifluoropropan-2-yloxy)pentan-2-amine
CID 66274577
4-(1,1,1-Trifluoropropan-2-yloxy)butan-2-amine
CID 66275001
4-(1,1,1-Trifluoropropan-2-yloxy)pentan-2-amine
CID 66275222
3-(1,1,1-Trifluoropropan-2-yloxy)cyclobutan-1-amine
CID 66350531
3-(3-Fluoropropoxy)cyclobutan-1-amine
CID 81113512
4-(2,2-Difluoroethoxy)pentan-2-amine
CID 82004351

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoroethoxy)pentan-2-amine?
The IUPAC name of 4-(2-fluoroethoxy)pentan-2-amine (CID 87578557) is 4-(2-fluoroethoxy)pentan-2-amine.
What is the SMILES notation for 4-(2-fluoroethoxy)pentan-2-amine?
The canonical SMILES for 4-(2-fluoroethoxy)pentan-2-amine is CC(N)CC(C)OCCF.
What is the InChIKey of 4-(2-fluoroethoxy)pentan-2-amine?
The InChIKey is RWSVITJYNREAKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16FNO/c1-6(9)5-7(2)10-4-3-8/h6-7H,3-5,9H2,1-2H3.
What are the key properties of 4-(2-fluoroethoxy)pentan-2-amine?
4-(2-fluoroethoxy)pentan-2-amine has a molecular weight of 149.21 g/mol, XLogP of 1.10, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoroethoxy)pentan-2-amine is sourced from PubChem (CID 87578557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).