[2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine

C10H18F2N2 — CID 130646471

IUPAC[2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine
SMILESNCC1CCCC1N1CCC(F)(F)C1
InChIInChI=1S/C10H18F2N2/c11-10(12)4-5-14(7-10)9-3-1-2-8(9)6-13/h8-9H,1-7,13H2
InChIKeyYJVKYQONGADHDB-UHFFFAOYSA-N
MW204.26 g/mol
LogP1.45
Rot. Bonds2

About [2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine

[2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine (PubChem CID 130646471) has the molecular formula C10H18F2N2 and a molecular weight of 204.26 g/mol. Its IUPAC name is [2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine
PubChem CID130646471
Molecular FormulaC10H18F2N2
Molecular Weight204.26 g/mol
Exact Mass204.14
IUPAC Name[2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine
SMILESNCC1CCCC1N1CCC(F)(F)C1
InChIInChI=1S/C10H18F2N2/c11-10(12)4-5-14(7-10)9-3-1-2-8(9)6-13/h8-9H,1-7,13H2
InChIKeyYJVKYQONGADHDB-UHFFFAOYSA-N
XLogP1.45
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.26
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine?
The IUPAC name of [2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine (CID 130646471) is [2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine.
What is the SMILES notation for [2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine?
The canonical SMILES for [2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine is NCC1CCCC1N1CCC(F)(F)C1.
What is the InChIKey of [2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine?
The InChIKey is YJVKYQONGADHDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F2N2/c11-10(12)4-5-14(7-10)9-3-1-2-8(9)6-13/h8-9H,1-7,13H2.
What are the key properties of [2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine?
[2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine has a molecular weight of 204.26 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine is sourced from PubChem (CID 130646471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).