2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid

C13H19N3O3 — CID 19622063

IUPAC2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid
SMILESCC1CCCN(C(=O)c2cnn(C(C)C(=O)O)c2)C1
InChIInChI=1S/C13H19N3O3/c1-9-4-3-5-15(7-9)12(17)11-6-14-16(8-11)10(2)13(18)19/h6,8-10H,3-5,7H2,1-2H3,(H,18,19)
InChIKeyZGEGSPSACJCXHB-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.40
Rot. Bonds3

About 2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid

2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid (PubChem CID 19622063) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid.

Molecular Properties

Compound Name2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid
PubChem CID19622063
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid
SMILESCC1CCCN(C(=O)c2cnn(C(C)C(=O)O)c2)C1
InChIInChI=1S/C13H19N3O3/c1-9-4-3-5-15(7-9)12(17)11-6-14-16(8-11)10(2)13(18)19/h6,8-10H,3-5,7H2,1-2H3,(H,18,19)
InChIKeyZGEGSPSACJCXHB-UHFFFAOYSA-N
XLogP1.40
TPSA75.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic 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-[4-(4-ethoxycarbonylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid
CID 19502953
(2S)-1-[(3R)-3-methylpiperidin-1-yl]-2-(4-phenylpyrazol-1-yl)propan-1-one
CID 100830764
(1-benzylpyrazol-4-yl)-[(3S)-3-methylpiperidin-1-yl]methanone
CID 35763357
1-[1-(3,5-dimethylpiperidin-1-yl)-1-oxopropan-2-yl]pyrazole-4-carboxylic acid
CID 19622428
5-methyl-1-(1-propan-2-ylpyrazole-4-carbonyl)piperidine-3-carboxylic acid
CID 122117281
2-[4-(cyclooctylcarbamoyl)pyrazol-1-yl]propanoic acid
CID 19622105
2-(4-carbamoylpyrazol-1-yl)propanoic acid
CID 19623315
(3-methylpiperidin-1-yl)-(6-phenyl-3-pyridinyl)methanone
CID 110683661
(3-methylpiperidin-1-yl)-[5-(propan-2-ylamino)-3-pyridinyl]methanone
CID 109223439
(3-methylpiperidin-1-yl)-(2-propan-2-yl-4-pyridinyl)methanone
CID 167555398
2-[4-[4-[(1-ethyl-5-methylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]propanoic acid
CID 19622148
4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxylic acid
CID 112700608

Frequently Asked Questions

What is the IUPAC name of 2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid?
The IUPAC name of 2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid (CID 19622063) is 2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid.
What is the SMILES notation for 2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid?
The canonical SMILES for 2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid is CC1CCCN(C(=O)c2cnn(C(C)C(=O)O)c2)C1.
What is the InChIKey of 2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid?
The InChIKey is ZGEGSPSACJCXHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-9-4-3-5-15(7-9)12(17)11-6-14-16(8-11)10(2)13(18)19/h6,8-10H,3-5,7H2,1-2H3,(H,18,19).
What are the key properties of 2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid?
2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid has a molecular weight of 265.31 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3-methylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid is sourced from PubChem (CID 19622063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).