2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid

C15H21N3O3 — CID 119924327

IUPAC2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid
SMILESCc1ccc(NC(=O)C2CCN(C(C)C(=O)O)CC2)nc1
InChIInChI=1S/C15H21N3O3/c1-10-3-4-13(16-9-10)17-14(19)12-5-7-18(8-6-12)11(2)15(20)21/h3-4,9,11-12H,5-8H2,1-2H3,(H,20,21)(H,16,17,19)
InChIKeySSERWACGGVWCTR-UHFFFAOYSA-N
MW291.35 g/mol
LogP1.51
Rot. Bonds4

About 2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid

2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid (PubChem CID 119924327) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid.

Molecular Properties

Compound Name2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid
PubChem CID119924327
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid
SMILESCc1ccc(NC(=O)C2CCN(C(C)C(=O)O)CC2)nc1
InChIInChI=1S/C15H21N3O3/c1-10-3-4-13(16-9-10)17-14(19)12-5-7-18(8-6-12)11(2)15(20)21/h3-4,9,11-12H,5-8H2,1-2H3,(H,20,21)(H,16,17,19)
InChIKeySSERWACGGVWCTR-UHFFFAOYSA-N
XLogP1.51
TPSA82.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(methylcarbamoylamino)-1-oxopropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 47066593
1-[(1S)-2-methyl-1-phenylpropyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 97006508
N-(5-methyl-2-pyridinyl)-1-[1-oxo-1-(2-phenylsulfanylanilino)propan-2-yl]piperidine-4-carboxamide
CID 55921400
1-[1-(2,5-dimethoxyanilino)-1-oxopropan-2-yl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55921796
N-(5-methyl-2-pyridinyl)-1-(2-propan-2-ylsulfonylpropanoyl)piperidine-4-carboxamide
CID 55993439
1-(6-methylpyridazin-3-yl)-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 121119029
1-(1-anilino-1-oxopropan-2-yl)-N-(5-chloro-2-pyridinyl)piperidine-4-carboxamide
CID 55816221
1-(4-chlorobenzoyl)-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 24980605
trans-(1S,3S)-3-methyl-N-(5-methyl-2-pyridinyl)cyclopentane-1-carboxamide
CID 58763333
N-(5-methyl-2-pyridinyl)cyclohex-3-ene-1-carboxamide
CID 42891852
2-[4-[[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]carbamoyl]piperidin-1-yl]propanoic acid
CID 166687824
1-(2-aminobenzoyl)-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide;dihydrochloride
CID 119946668

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid?
The IUPAC name of 2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid (CID 119924327) is 2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid.
What is the SMILES notation for 2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid?
The canonical SMILES for 2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid is Cc1ccc(NC(=O)C2CCN(C(C)C(=O)O)CC2)nc1.
What is the InChIKey of 2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid?
The InChIKey is SSERWACGGVWCTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-10-3-4-13(16-9-10)17-14(19)12-5-7-18(8-6-12)11(2)15(20)21/h3-4,9,11-12H,5-8H2,1-2H3,(H,20,21)(H,16,17,19).
What are the key properties of 2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid?
2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid has a molecular weight of 291.35 g/mol, XLogP of 1.51, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid is sourced from PubChem (CID 119924327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).