(3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid

C18H19NO2 — CID 11868274

IUPAC(3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid
SMILESO=C(O)[C@H]1CN[C@@H](c2ccccc2)C[C@H]1c1ccccc1
InChIInChI=1S/C18H19NO2/c20-18(21)16-12-19-17(14-9-5-2-6-10-14)11-15(16)13-7-3-1-4-8-13/h1-10,15-17,19H,11-12H2,(H,20,21)/t15-,16-,17+/m0/s1
InChIKeyNIPZGSKSNHPVNC-YESZJQIVSA-N
MW281.36 g/mol
LogP3.21
Rot. Bonds3

About (3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid

(3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid (PubChem CID 11868274) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is (3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid.

Molecular Properties

Compound Name(3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid
PubChem CID11868274
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC Name(3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid
SMILESO=C(O)[C@H]1CN[C@@H](c2ccccc2)C[C@H]1c1ccccc1
InChIInChI=1S/C18H19NO2/c20-18(21)16-12-19-17(14-9-5-2-6-10-14)11-15(16)13-7-3-1-4-8-13/h1-10,15-17,19H,11-12H2,(H,20,21)/t15-,16-,17+/m0/s1
InChIKeyNIPZGSKSNHPVNC-YESZJQIVSA-N
XLogP3.21
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (3R,4R,6R)-4,6-diphenylpiperidine-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

cis-(1R,2S)-2-phenylcyclopropane-1-carboxylic acid
CID 778516
ethane;2-phenylcyclopropane-1-carboxylic acid
CID 91570346
(2R,4R)-4-methyl-2-phenylpyrrolidine
CID 101063094
acetic acid;2,5-diphenylpiperazine
CID 157254746
ethane;4-methyl-2-phenylpyrrolidine
CID 142973679
5-phenylpyrrolidin-3-amine
CID 83854505
ethane;(2S)-2-phenylaziridine
CID 145185749
trans-methyl (1S,2S)-2-phenylcyclopropane-1-carboxylate
CID 642984
5-(4-bromophenyl)pyrrolidine-3-carboxylic acid
CID 82625541
(3R,4R)-4-phenylthiolane-3-carboxylic acid
CID 101058363
2-chloro-1-[(1S,2R)-2-phenylcyclopropyl]ethanone
CID 164769669
2,7-diphenyl-2,3,4a,5,6,7,8,8a-octahydro-1H-1,6-naphthyridin-4-one
CID 118630174

Frequently Asked Questions

What is the IUPAC name of (3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid?
The IUPAC name of (3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid (CID 11868274) is (3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid.
What is the SMILES notation for (3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid?
The canonical SMILES for (3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid is O=C(O)[C@H]1CN[C@@H](c2ccccc2)C[C@H]1c1ccccc1.
What is the InChIKey of (3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid?
The InChIKey is NIPZGSKSNHPVNC-YESZJQIVSA-N. The full InChI is InChI=1S/C18H19NO2/c20-18(21)16-12-19-17(14-9-5-2-6-10-14)11-15(16)13-7-3-1-4-8-13/h1-10,15-17,19H,11-12H2,(H,20,21)/t15-,16-,17+/m0/s1.
What are the key properties of (3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid?
(3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid has a molecular weight of 281.36 g/mol, XLogP of 3.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid is sourced from PubChem (CID 11868274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).