2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid

C15H19FN2O3 — CID 61191042

IUPAC2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid
SMILESCc1ccc(F)cc1NC(=O)N1CCCCC1CC(=O)O
InChIInChI=1S/C15H19FN2O3/c1-10-5-6-11(16)8-13(10)17-15(21)18-7-3-2-4-12(18)9-14(19)20/h5-6,8,12H,2-4,7,9H2,1H3,(H,17,21)(H,19,20)
InChIKeyQNZQFJPUOUARLH-UHFFFAOYSA-N
MW294.33 g/mol
LogP3.00
Rot. Bonds3

About 2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid

2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid (PubChem CID 61191042) has the molecular formula C15H19FN2O3 and a molecular weight of 294.33 g/mol. Its IUPAC name is 2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid
PubChem CID61191042
Molecular FormulaC15H19FN2O3
Molecular Weight294.33 g/mol
Exact Mass294.14
IUPAC Name2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid
SMILESCc1ccc(F)cc1NC(=O)N1CCCCC1CC(=O)O
InChIInChI=1S/C15H19FN2O3/c1-10-5-6-11(16)8-13(10)17-15(21)18-7-3-2-4-12(18)9-14(19)20/h5-6,8,12H,2-4,7,9H2,1H3,(H,17,21)(H,19,20)
InChIKeyQNZQFJPUOUARLH-UHFFFAOYSA-N
XLogP3.00
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[1-[(2,5-difluorophenyl)carbamoyl]piperidin-2-yl]acetic acid
CID 61182627
2-[1-[(4-fluoro-2-iodophenyl)carbamoyl]piperidin-2-yl]acetic acid
CID 79760864
1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidine-2-carboxylic acid
CID 61192061
2-[4-[(5-fluoro-2-methylphenyl)carbamoyl]thiomorpholin-3-yl]acetic acid
CID 66444323
N-(5-fluoro-2-methylphenyl)-2-(2-morpholin-4-ylethyl)piperidine-1-carboxamide
CID 56894380
2-[1-[(2-ethylphenyl)carbamoyl]piperidin-2-yl]acetic acid
CID 61190378
2-[1-[(4-methoxy-2-methylphenyl)carbamoyl]pyrrolidin-2-yl]acetic acid
CID 62871728
2-[1-[(2-bromo-4-methylphenyl)carbamoyl]pyrrolidin-2-yl]acetic acid
CID 61372529
2-[1-[(3-chloro-4-fluorophenyl)carbamoyl]piperidin-2-yl]acetic acid
CID 61194799
(2S)-2-N-[dimethyl(oxo)-λ6-sulfanylidene]-1-N-(5-fluoro-2-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 126831359
1-[1-(5-fluoro-2-methylbenzoyl)azepan-2-yl]propan-2-one
CID 79541273
2-[1-[(3-methylsulfanylphenyl)carbamoyl]piperidin-2-yl]acetic acid
CID 61181332

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid?
The IUPAC name of 2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid (CID 61191042) is 2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid.
What is the SMILES notation for 2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid?
The canonical SMILES for 2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid is Cc1ccc(F)cc1NC(=O)N1CCCCC1CC(=O)O.
What is the InChIKey of 2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid?
The InChIKey is QNZQFJPUOUARLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O3/c1-10-5-6-11(16)8-13(10)17-15(21)18-7-3-2-4-12(18)9-14(19)20/h5-6,8,12H,2-4,7,9H2,1H3,(H,17,21)(H,19,20).
What are the key properties of 2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid?
2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid has a molecular weight of 294.33 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(5-fluoro-2-methylphenyl)carbamoyl]piperidin-2-yl]acetic acid is sourced from PubChem (CID 61191042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).