5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid

C14H26N2O2 — CID 165455349

IUPAC5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid
SMILESCC(C)N1CCC(C2CNCC(C(=O)O)C2)CC1
InChIInChI=1S/C14H26N2O2/c1-10(2)16-5-3-11(4-6-16)12-7-13(14(17)18)9-15-8-12/h10-13,15H,3-9H2,1-2H3,(H,17,18)
InChIKeyNUJLZXGTMZRYPU-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.42
Rot. Bonds3

About 5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid

5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid (PubChem CID 165455349) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid.

Molecular Properties

Compound Name5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid
PubChem CID165455349
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid
SMILESCC(C)N1CCC(C2CNCC(C(=O)O)C2)CC1
InChIInChI=1S/C14H26N2O2/c1-10(2)16-5-3-11(4-6-16)12-7-13(14(17)18)9-15-8-12/h10-13,15H,3-9H2,1-2H3,(H,17,18)
InChIKeyNUJLZXGTMZRYPU-UHFFFAOYSA-N
XLogP1.42
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-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

5-(4-propan-2-ylcyclohexyl)piperidine-3-carboxylic acid
CID 165455355
1-propan-2-yl-4-(1-propan-2-ylpiperidin-4-yl)piperidine
CID 59059970
5-(2-methyloxan-4-yl)piperidine-3-carboxylic acid
CID 165449963
4-cyclopropyl-1-propan-2-ylpiperidine
CID 70331530
2-methyl-1-[4-(1-propan-2-ylpiperidin-4-yl)piperidin-1-yl]propan-1-one
CID 169054534
ethane;1-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 177135939
propan-2-yl 1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-5-carboxylate
CID 25094471
2,3,4,4a,5,6,7,7a-octahydro-1H-pyrrolo[3,4-b]pyridine-3-carboxylic acid
CID 83816195
(3S)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide
CID 81124488
1-propan-2-ylazepane-3-carboxylic acid
CID 83618658
1-(1-cyclopentylethyl)piperidine-4-carboxylic acid
CID 65056131
(3S,5S)-5-(azetidin-1-yl)piperidine-3-carboxylic acid
CID 125457412

Frequently Asked Questions

What is the IUPAC name of 5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid?
The IUPAC name of 5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid (CID 165455349) is 5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid.
What is the SMILES notation for 5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid?
The canonical SMILES for 5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid is CC(C)N1CCC(C2CNCC(C(=O)O)C2)CC1.
What is the InChIKey of 5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid?
The InChIKey is NUJLZXGTMZRYPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-10(2)16-5-3-11(4-6-16)12-7-13(14(17)18)9-15-8-12/h10-13,15H,3-9H2,1-2H3,(H,17,18).
What are the key properties of 5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid?
5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid has a molecular weight of 254.37 g/mol, XLogP of 1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxylic acid is sourced from PubChem (CID 165455349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).