2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide

C15H17F2NO — CID 159817588

IUPAC2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide
SMILESC[C@H](CC1=CCc2ccccc21)NC(=O)C(C)(F)F
InChIInChI=1S/C15H17F2NO/c1-10(18-14(19)15(2,16)17)9-12-8-7-11-5-3-4-6-13(11)12/h3-6,8,10H,7,9H2,1-2H3,(H,18,19)/t10-/m1/s1
InChIKeyNLUSOXOUUMCHES-SNVBAGLBSA-N
MW265.30 g/mol
LogP3.18
Rot. Bonds4

About 2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide

2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide (PubChem CID 159817588) has the molecular formula C15H17F2NO and a molecular weight of 265.30 g/mol. Its IUPAC name is 2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide.

Molecular Properties

Compound Name2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide
PubChem CID159817588
Molecular FormulaC15H17F2NO
Molecular Weight265.30 g/mol
Exact Mass265.13
IUPAC Name2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide
SMILESC[C@H](CC1=CCc2ccccc21)NC(=O)C(C)(F)F
InChIInChI=1S/C15H17F2NO/c1-10(18-14(19)15(2,16)17)9-12-8-7-11-5-3-4-6-13(11)12/h3-6,8,10H,7,9H2,1-2H3,(H,18,19)/t10-/m1/s1
InChIKeyNLUSOXOUUMCHES-SNVBAGLBSA-N
XLogP3.18
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.30
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide?
The IUPAC name of 2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide (CID 159817588) is 2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide.
What is the SMILES notation for 2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide?
The canonical SMILES for 2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide is C[C@H](CC1=CCc2ccccc21)NC(=O)C(C)(F)F.
What is the InChIKey of 2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide?
The InChIKey is NLUSOXOUUMCHES-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H17F2NO/c1-10(18-14(19)15(2,16)17)9-12-8-7-11-5-3-4-6-13(11)12/h3-6,8,10H,7,9H2,1-2H3,(H,18,19)/t10-/m1/s1.
What are the key properties of 2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide?
2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide has a molecular weight of 265.30 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-[(2R)-1-(3H-inden-1-yl)propan-2-yl]propanamide is sourced from PubChem (CID 159817588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).