N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine

C8H16FNO — CID 131224112

IUPACN-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine
SMILESCOC1CC(NC(C)CF)C1
InChIInChI=1S/C8H16FNO/c1-6(5-9)10-7-3-8(4-7)11-2/h6-8,10H,3-5H2,1-2H3
InChIKeyHWLRDKJGPJJWMG-UHFFFAOYSA-N
MW161.22 g/mol
LogP1.11
Rot. Bonds4

About N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine

N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine (PubChem CID 131224112) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine.

Molecular Properties

Compound NameN-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine
PubChem CID131224112
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC NameN-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine
SMILESCOC1CC(NC(C)CF)C1
InChIInChI=1S/C8H16FNO/c1-6(5-9)10-7-3-8(4-7)11-2/h6-8,10H,3-5H2,1-2H3
InChIKeyHWLRDKJGPJJWMG-UHFFFAOYSA-N
XLogP1.11
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

rac-(1r,3r)-3-methoxy-N-methylcyclobutan-1-amine
CID 55295891
N-methyl-3-(2,2,2-trifluoroethoxy)cyclobutan-1-amine
CID 66356960
2-fluoro-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine
CID 134581779
N-methyl-3-(trifluoromethoxy)cyclobutan-1-amine
CID 155122294
N-propan-2-yl-3-(trifluoromethoxy)cyclobutan-1-amine
CID 155138949
4,4,4-trifluoro-3-methoxy-N-propan-2-ylbutan-1-amine
CID 155139108
3-[3-[[(1R,2S)-2-fluorocyclopropyl]amino]butoxy]-N-propan-2-ylcyclobutan-1-amine
CID 170154282
N-ethyl-3-(trifluoromethoxy)cyclobutan-1-amine
CID 170420954
N-propylcyclobutanamine;1-(trifluoromethoxy)butane
CID 172335452
cis-(1S,2R)-2-(2-fluoropropoxy)-N-methylcyclobutan-1-amine
CID 174340922
N-methyl-3-(1,2,2-trifluoroethoxy)cyclobutan-1-amine
CID 175543881
N-propyl-4-(2,2,2-trifluoroethoxy)pentan-2-amine
CID 64706243

Frequently Asked Questions

What is the IUPAC name of N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine?
The IUPAC name of N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine (CID 131224112) is N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine.
What is the SMILES notation for N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine?
The canonical SMILES for N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine is COC1CC(NC(C)CF)C1.
What is the InChIKey of N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine?
The InChIKey is HWLRDKJGPJJWMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c1-6(5-9)10-7-3-8(4-7)11-2/h6-8,10H,3-5H2,1-2H3.
What are the key properties of N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine?
N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine has a molecular weight of 161.22 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-fluoropropan-2-yl)-3-methoxycyclobutan-1-amine is sourced from PubChem (CID 131224112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).