N-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine

C11H20FNO — CID 126847976

IUPACN-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine
SMILESFC1(CNCC2CCCO2)CCCC1
InChIInChI=1S/C11H20FNO/c12-11(5-1-2-6-11)9-13-8-10-4-3-7-14-10/h10,13H,1-9H2
InChIKeyACBYRBSCGQZDOU-UHFFFAOYSA-N
MW201.28 g/mol
LogP2.04
Rot. Bonds4

About N-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine

N-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine (PubChem CID 126847976) has the molecular formula C11H20FNO and a molecular weight of 201.28 g/mol. Its IUPAC name is N-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine.

Molecular Properties

Compound NameN-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine
PubChem CID126847976
Molecular FormulaC11H20FNO
Molecular Weight201.28 g/mol
Exact Mass201.15
IUPAC NameN-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine
SMILESFC1(CNCC2CCCO2)CCCC1
InChIInChI=1S/C11H20FNO/c12-11(5-1-2-6-11)9-13-8-10-4-3-7-14-10/h10,13H,1-9H2
InChIKeyACBYRBSCGQZDOU-UHFFFAOYSA-N
XLogP2.04
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.28
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine?
The IUPAC name of N-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine (CID 126847976) is N-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine.
What is the SMILES notation for N-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine?
The canonical SMILES for N-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine is FC1(CNCC2CCCO2)CCCC1.
What is the InChIKey of N-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine?
The InChIKey is ACBYRBSCGQZDOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20FNO/c12-11(5-1-2-6-11)9-13-8-10-4-3-7-14-10/h10,13H,1-9H2.
What are the key properties of N-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine?
N-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine has a molecular weight of 201.28 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-fluorocyclopentyl)methyl]-1-(oxolan-2-yl)methanamine is sourced from PubChem (CID 126847976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).