[2-(difluoromethoxy)cyclopentyl]methanamine

C7H13F2NO — CID 84717030

IUPAC[2-(difluoromethoxy)cyclopentyl]methanamine
SMILESNCC1CCCC1OC(F)F
InChIInChI=1S/C7H13F2NO/c8-7(9)11-6-3-1-2-5(6)4-10/h5-7H,1-4,10H2
InChIKeyCGIJRNCMQZFHPF-UHFFFAOYSA-N
MW165.18 g/mol
LogP1.35
Rot. Bonds3

About [2-(difluoromethoxy)cyclopentyl]methanamine

[2-(difluoromethoxy)cyclopentyl]methanamine (PubChem CID 84717030) has the molecular formula C7H13F2NO and a molecular weight of 165.18 g/mol. Its IUPAC name is [2-(difluoromethoxy)cyclopentyl]methanamine.

Molecular Properties

Compound Name[2-(difluoromethoxy)cyclopentyl]methanamine
PubChem CID84717030
Molecular FormulaC7H13F2NO
Molecular Weight165.18 g/mol
Exact Mass165.10
IUPAC Name[2-(difluoromethoxy)cyclopentyl]methanamine
SMILESNCC1CCCC1OC(F)F
InChIInChI=1S/C7H13F2NO/c8-7(9)11-6-3-1-2-5(6)4-10/h5-7H,1-4,10H2
InChIKeyCGIJRNCMQZFHPF-UHFFFAOYSA-N
XLogP1.35
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.18
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(2,2,2-Trifluoroethoxy)cyclopentyl]methanamine
CID 43428736
[2-(2,2,3,3-Tetrafluoropropoxy)cyclopentyl]methanamine
CID 43428920
[2-[2-(Trifluoromethoxy)ethoxy]cyclopentyl]methanamine
CID 65835831
[2-(2,2-Difluoroethoxy)cyclopentyl]methanamine
CID 65836434
[2-[3-(2,2,2-Trifluoroethoxy)propoxy]cyclopentyl]methanamine
CID 65836444
[2-[2-(2,2,2-Trifluoroethoxy)ethoxy]cyclopentyl]methanamine
CID 65838481
[2-(3,3,3-Trifluoropropoxy)cyclopentyl]methanamine
CID 65838681
3-(Cyclopentylmethoxy)-4,4,4-trifluorobutan-1-amine
CID 66322383
[2-(2-Fluoroethoxy)cyclopentyl]methanamine
CID 80694931
[2-(3-Fluoropropoxy)cyclopentyl]methanamine
CID 81113274
[3-(Difluoromethoxy)cyclopentyl]methanamine
CID 84717028
2-Cyclopentyl-2-(difluoromethoxy)ethanamine
CID 84718113

Frequently Asked Questions

What is the IUPAC name of [2-(difluoromethoxy)cyclopentyl]methanamine?
The IUPAC name of [2-(difluoromethoxy)cyclopentyl]methanamine (CID 84717030) is [2-(difluoromethoxy)cyclopentyl]methanamine.
What is the SMILES notation for [2-(difluoromethoxy)cyclopentyl]methanamine?
The canonical SMILES for [2-(difluoromethoxy)cyclopentyl]methanamine is NCC1CCCC1OC(F)F.
What is the InChIKey of [2-(difluoromethoxy)cyclopentyl]methanamine?
The InChIKey is CGIJRNCMQZFHPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2NO/c8-7(9)11-6-3-1-2-5(6)4-10/h5-7H,1-4,10H2.
What are the key properties of [2-(difluoromethoxy)cyclopentyl]methanamine?
[2-(difluoromethoxy)cyclopentyl]methanamine has a molecular weight of 165.18 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(difluoromethoxy)cyclopentyl]methanamine is sourced from PubChem (CID 84717030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).