2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide

C10H16F4N2O — CID 106291826

IUPAC2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide
SMILESCC1(C(=O)NCC(F)(F)C(F)F)CCCC1N
InChIInChI=1S/C10H16F4N2O/c1-9(4-2-3-6(9)15)8(17)16-5-10(13,14)7(11)12/h6-7H,2-5,15H2,1H3,(H,16,17)
InChIKeyAMHGKORJQMUYMG-UHFFFAOYSA-N
MW256.24 g/mol
LogP1.52
Rot. Bonds4

About 2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide

2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide (PubChem CID 106291826) has the molecular formula C10H16F4N2O and a molecular weight of 256.24 g/mol. Its IUPAC name is 2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide
PubChem CID106291826
Molecular FormulaC10H16F4N2O
Molecular Weight256.24 g/mol
Exact Mass256.12
IUPAC Name2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide
SMILESCC1(C(=O)NCC(F)(F)C(F)F)CCCC1N
InChIInChI=1S/C10H16F4N2O/c1-9(4-2-3-6(9)15)8(17)16-5-10(13,14)7(11)12/h6-7H,2-5,15H2,1H3,(H,16,17)
InChIKeyAMHGKORJQMUYMG-UHFFFAOYSA-N
XLogP1.52
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.24
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide (CID 106291826) is 2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide is CC1(C(=O)NCC(F)(F)C(F)F)CCCC1N.
What is the InChIKey of 2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide?
The InChIKey is AMHGKORJQMUYMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F4N2O/c1-9(4-2-3-6(9)15)8(17)16-5-10(13,14)7(11)12/h6-7H,2-5,15H2,1H3,(H,16,17).
What are the key properties of 2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide?
2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide has a molecular weight of 256.24 g/mol, XLogP of 1.52, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 106291826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).