2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine

C10H17F2NO — CID 164659617

IUPAC2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine
SMILESCC1(CC(N)C2CCOC2)CC1(F)F
InChIInChI=1S/C10H17F2NO/c1-9(6-10(9,11)12)4-8(13)7-2-3-14-5-7/h7-8H,2-6,13H2,1H3
InChIKeyHAXWJXQMKGNWNH-UHFFFAOYSA-N
MW205.25 g/mol
LogP1.79
Rot. Bonds3

About 2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine

2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine (PubChem CID 164659617) has the molecular formula C10H17F2NO and a molecular weight of 205.25 g/mol. Its IUPAC name is 2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine
PubChem CID164659617
Molecular FormulaC10H17F2NO
Molecular Weight205.25 g/mol
Exact Mass205.13
IUPAC Name2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine
SMILESCC1(CC(N)C2CCOC2)CC1(F)F
InChIInChI=1S/C10H17F2NO/c1-9(6-10(9,11)12)4-8(13)7-2-3-14-5-7/h7-8H,2-6,13H2,1H3
InChIKeyHAXWJXQMKGNWNH-UHFFFAOYSA-N
XLogP1.79
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.25
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(oxolan-3-yl)butan-1-amine
CID 63564938
1-(oxolan-3-yl)butan-1-amine;hydrate
CID 174673469
1-(oxolan-3-yl)-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
CID 104749589
1,2-bis(oxolan-3-yl)ethanamine
CID 103986754
5,5-dimethyl-1-(oxolan-3-yl)hex-3-yn-1-amine
CID 126973745
N',N'-bis(3-methylbutyl)-1-(oxolan-3-yl)ethane-1,2-diamine
CID 107869656
(1R)-1-[(3S)-oxolan-3-yl]ethanamine
CID 95396571
2-[(2-methylpropan-2-yl)oxy]-1-(oxolan-3-yl)ethanamine
CID 104748924
2-(3-methylbutan-2-ylsulfanyl)-1-(oxolan-3-yl)ethanamine
CID 107763469
1-[2-amino-2-(oxolan-3-yl)ethyl]-4-propylpiperazine-2,5-dione
CID 104747986
1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine
CID 104746984
2-(2-methylpropylsulfonyl)-1-(oxolan-3-yl)ethanamine
CID 104753957

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine?
The IUPAC name of 2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine (CID 164659617) is 2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine.
What is the SMILES notation for 2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine?
The canonical SMILES for 2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine is CC1(CC(N)C2CCOC2)CC1(F)F.
What is the InChIKey of 2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine?
The InChIKey is HAXWJXQMKGNWNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F2NO/c1-9(6-10(9,11)12)4-8(13)7-2-3-14-5-7/h7-8H,2-6,13H2,1H3.
What are the key properties of 2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine?
2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine has a molecular weight of 205.25 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-3-yl)ethanamine is sourced from PubChem (CID 164659617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).