(4Z)-4-propylidenepiperidine-2-carboxylic acid

C9H15NO2 — CID 69221471

IUPAC(4Z)-4-propylidenepiperidine-2-carboxylic acid
SMILESCC/C=C1/CCNC(C(=O)O)C1
InChIInChI=1S/C9H15NO2/c1-2-3-7-4-5-10-8(6-7)9(11)12/h3,8,10H,2,4-6H2,1H3,(H,11,12)/b7-3-
InChIKeyLTLKPBZNDJKLHE-CLTKARDFSA-N
MW169.22 g/mol
LogP1.16
Rot. Bonds2

About (4Z)-4-propylidenepiperidine-2-carboxylic acid

(4Z)-4-propylidenepiperidine-2-carboxylic acid (PubChem CID 69221471) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is (4Z)-4-propylidenepiperidine-2-carboxylic acid.

Molecular Properties

Compound Name(4Z)-4-propylidenepiperidine-2-carboxylic acid
PubChem CID69221471
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name(4Z)-4-propylidenepiperidine-2-carboxylic acid
SMILESCC/C=C1/CCNC(C(=O)O)C1
InChIInChI=1S/C9H15NO2/c1-2-3-7-4-5-10-8(6-7)9(11)12/h3,8,10H,2,4-6H2,1H3,(H,11,12)/b7-3-
InChIKeyLTLKPBZNDJKLHE-CLTKARDFSA-N
XLogP1.16
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (4Z)-4-propylidenepiperidine-2-carboxylic 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

3-(1,2,3,6-Tetrahydro-pyridin-4-yl)-propionic acid
CID 10057740
5-Methylidenepiperidine-2-carboxylic acid
CID 91220064
(2S)-4-methylidenepiperidine-2-carboxylic acid;2,2,2-trifluoroacetic acid
CID 69558180
3-Vinylpipecolic acid
CID 129710212
1-Hydroxyoct-6-enoylglycine
CID 131802916
(2R,3S)-3-prop-1-en-2-ylpiperidine-2-carboxylic acid
CID 14334519
methyl (2R)-4-methylidenepiperidine-2-carboxylate
CID 10855708
(2R,6R)-4-methylidenepiperidine-2,6-dicarboxylic acid
CID 15713251
5-propyl-2,3,6,7-tetrahydro-1H-azepine-2-carboxylic acid
CID 18446309
4-Propyl-1,2,3,6-tetrahydropyridine-2-carboxylic acid
CID 18446365
4-Butyl-1,2,3,6-tetrahydropyridine-2-carboxylic acid
CID 18446394
4-Methylidenepiperidine-2,6-dicarboxylic acid
CID 19881331

Frequently Asked Questions

What is the IUPAC name of (4Z)-4-propylidenepiperidine-2-carboxylic acid?
The IUPAC name of (4Z)-4-propylidenepiperidine-2-carboxylic acid (CID 69221471) is (4Z)-4-propylidenepiperidine-2-carboxylic acid.
What is the SMILES notation for (4Z)-4-propylidenepiperidine-2-carboxylic acid?
The canonical SMILES for (4Z)-4-propylidenepiperidine-2-carboxylic acid is CC/C=C1/CCNC(C(=O)O)C1.
What is the InChIKey of (4Z)-4-propylidenepiperidine-2-carboxylic acid?
The InChIKey is LTLKPBZNDJKLHE-CLTKARDFSA-N. The full InChI is InChI=1S/C9H15NO2/c1-2-3-7-4-5-10-8(6-7)9(11)12/h3,8,10H,2,4-6H2,1H3,(H,11,12)/b7-3-.
What are the key properties of (4Z)-4-propylidenepiperidine-2-carboxylic acid?
(4Z)-4-propylidenepiperidine-2-carboxylic acid has a molecular weight of 169.22 g/mol, XLogP of 1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-propylidenepiperidine-2-carboxylic acid is sourced from PubChem (CID 69221471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).