2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide

C16H20FNO — CID 164984454

IUPAC2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide
SMILESO=C(Cc1ccc(C2CC2)cc1)N[C@H]1CCC[C@@H]1F
InChIInChI=1S/C16H20FNO/c17-14-2-1-3-15(14)18-16(19)10-11-4-6-12(7-5-11)13-8-9-13/h4-7,13-15H,1-3,8-10H2,(H,18,19)/t14-,15-/m0/s1
InChIKeyFYMOHOKQDADQDQ-GJZGRUSLSA-N
MW261.34 g/mol
LogP3.11
Rot. Bonds4

About 2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide

2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide (PubChem CID 164984454) has the molecular formula C16H20FNO and a molecular weight of 261.34 g/mol. Its IUPAC name is 2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide.

Molecular Properties

Compound Name2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide
PubChem CID164984454
Molecular FormulaC16H20FNO
Molecular Weight261.34 g/mol
Exact Mass261.15
IUPAC Name2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide
SMILESO=C(Cc1ccc(C2CC2)cc1)N[C@H]1CCC[C@@H]1F
InChIInChI=1S/C16H20FNO/c17-14-2-1-3-15(14)18-16(19)10-11-4-6-12(7-5-11)13-8-9-13/h4-7,13-15H,1-3,8-10H2,(H,18,19)/t14-,15-/m0/s1
InChIKeyFYMOHOKQDADQDQ-GJZGRUSLSA-N
XLogP3.11
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.34
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide?
The IUPAC name of 2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide (CID 164984454) is 2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide.
What is the SMILES notation for 2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide?
The canonical SMILES for 2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide is O=C(Cc1ccc(C2CC2)cc1)N[C@H]1CCC[C@@H]1F.
What is the InChIKey of 2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide?
The InChIKey is FYMOHOKQDADQDQ-GJZGRUSLSA-N. The full InChI is InChI=1S/C16H20FNO/c17-14-2-1-3-15(14)18-16(19)10-11-4-6-12(7-5-11)13-8-9-13/h4-7,13-15H,1-3,8-10H2,(H,18,19)/t14-,15-/m0/s1.
What are the key properties of 2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide?
2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide has a molecular weight of 261.34 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropylphenyl)-N-[(1S,2S)-2-fluorocyclopentyl]acetamide is sourced from PubChem (CID 164984454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).