2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide

C14H18FNO — CID 110355345

IUPAC2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)C(c1ccc(F)cc1)C1CC1
InChIInChI=1S/C14H18FNO/c1-9(2)16-14(17)13(10-3-4-10)11-5-7-12(15)8-6-11/h5-10,13H,3-4H2,1-2H3,(H,16,17)
InChIKeyQABDAHYZTCJXSI-UHFFFAOYSA-N
MW235.30 g/mol
LogP2.84
Rot. Bonds4

About 2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide

2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide (PubChem CID 110355345) has the molecular formula C14H18FNO and a molecular weight of 235.30 g/mol. Its IUPAC name is 2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide
PubChem CID110355345
Molecular FormulaC14H18FNO
Molecular Weight235.30 g/mol
Exact Mass235.14
IUPAC Name2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)C(c1ccc(F)cc1)C1CC1
InChIInChI=1S/C14H18FNO/c1-9(2)16-14(17)13(10-3-4-10)11-5-7-12(15)8-6-11/h5-10,13H,3-4H2,1-2H3,(H,16,17)
InChIKeyQABDAHYZTCJXSI-UHFFFAOYSA-N
XLogP2.84
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclopropyl-2-(4-fluorophenyl)-N-(1-hydroxypropan-2-yl)acetamide
CID 110428220
methyl 2-cyclopropyl-2-(4-fluorophenyl)acetate
CID 82077609
2-cyclopropyl-2-(4-fluorophenyl)-N-pentylacetamide
CID 110355902
methyl (2R)-2-cyclopentyl-2-(4-fluorophenyl)acetate
CID 124640320
2-cyclopropyl-2-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxypropyl]acetamide
CID 110629945
2-cyclopropyl-2-(4-fluorophenyl)-N-(4-methoxybutyl)acetamide
CID 110610202
N-benzyl-2-cyclopropyl-2-(4-fluorophenyl)acetamide
CID 110355576
4-[(4-fluorophenyl)-hydroxymethyl]-N-propan-2-ylpiperidine-1-carboxamide
CID 111109261
2-[[(1R)-1-(4-fluorophenyl)ethyl]amino]-N-propan-2-ylpropanamide
CID 81347234
2-cyclopropyl-N-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)acetamide
CID 110356066
2-(4-fluorophenyl)-2-(oxan-4-yl)acetic acid
CID 82388803
2-chloro-N-[1-[1-[2-cyclopropyl-2-(4-fluorophenyl)acetyl]piperidin-4-yl]ethyl]acetamide
CID 154874831

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide?
The IUPAC name of 2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide (CID 110355345) is 2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide is CC(C)NC(=O)C(c1ccc(F)cc1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide?
The InChIKey is QABDAHYZTCJXSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO/c1-9(2)16-14(17)13(10-3-4-10)11-5-7-12(15)8-6-11/h5-10,13H,3-4H2,1-2H3,(H,16,17).
What are the key properties of 2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide?
2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide has a molecular weight of 235.30 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(4-fluorophenyl)-N-propan-2-ylacetamide is sourced from PubChem (CID 110355345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).