(3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide

C22H31N3O2 — CID 56859378

IUPAC(3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide
SMILESO=C(Nc1ccc2c(c1)CCC2)[C@H]1CNC[C@@H](C(=O)NC2CCCCC2)C1
InChIInChI=1S/C22H31N3O2/c26-21(24-19-7-2-1-3-8-19)17-11-18(14-23-13-17)22(27)25-20-10-9-15-5-4-6-16(15)12-20/h9-10,12,17-19,23H,1-8,11,13-14H2,(H,24,26)(H,25,27)/t17-,18+/m0/s1
InChIKeyUSGXZBDDWJOZPX-ZWKOTPCHSA-N
MW369.51 g/mol
LogP2.79
Rot. Bonds4

About (3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide

(3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide (PubChem CID 56859378) has the molecular formula C22H31N3O2 and a molecular weight of 369.51 g/mol. Its IUPAC name is (3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide.

Molecular Properties

Compound Name(3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide
PubChem CID56859378
Molecular FormulaC22H31N3O2
Molecular Weight369.51 g/mol
Exact Mass369.24
IUPAC Name(3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide
SMILESO=C(Nc1ccc2c(c1)CCC2)[C@H]1CNC[C@@H](C(=O)NC2CCCCC2)C1
InChIInChI=1S/C22H31N3O2/c26-21(24-19-7-2-1-3-8-19)17-11-18(14-23-13-17)22(27)25-20-10-9-15-5-4-6-16(15)12-20/h9-10,12,17-19,23H,1-8,11,13-14H2,(H,24,26)(H,25,27)/t17-,18+/m0/s1
InChIKeyUSGXZBDDWJOZPX-ZWKOTPCHSA-N
XLogP2.79
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.51
LogP ≤ 52.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide 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

(3R,5S)-3-N-(2,3-dihydro-1H-inden-5-yl)-5-N,5-N-dimethylpiperidine-3,5-dicarboxamide
CID 56858647
N-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrrolidine-3-carboxamide
CID 115159350
1-cycloheptyl-3-(2,3-dihydro-1H-inden-5-yl)urea
CID 47132834
1-cyclohexyl-3-(2,3-dihydro-1H-inden-5-yl)urea
CID 3271031
(3S,5R)-5-N-(2,3-dihydro-1H-inden-5-yl)-3-N-[(4-methylphenyl)methyl]piperidine-3,5-dicarboxamide
CID 56852887
(3S,5R)-3-N-cyclopropyl-5-N-(2,3-dihydro-1H-inden-5-yl)-1-(pyridin-4-ylmethyl)piperidine-3,5-dicarboxamide
CID 56859918
(3S,5R)-3-N-cyclopropyl-5-N-(2,3-dihydro-1H-inden-5-yl)-1-(2-phenylethyl)piperidine-3,5-dicarboxamide
CID 56858429
(1S,5R)-N-(2,3-dihydro-1H-inden-5-yl)-9-oxobicyclo[3.3.1]nonane-3-carboxamide
CID 8920716
N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
CID 119713611
3-amino-N-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobutane-1-carboxamide
CID 115161265
(3R)-N-(1,3-dihydro-2-benzofuran-5-yl)piperidine-3-carboxamide
CID 114263025
N-[4-chloro-3-(cyclohexylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 119300196

Frequently Asked Questions

What is the IUPAC name of (3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide?
The IUPAC name of (3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide (CID 56859378) is (3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide.
What is the SMILES notation for (3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide?
The canonical SMILES for (3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide is O=C(Nc1ccc2c(c1)CCC2)[C@H]1CNC[C@@H](C(=O)NC2CCCCC2)C1.
What is the InChIKey of (3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide?
The InChIKey is USGXZBDDWJOZPX-ZWKOTPCHSA-N. The full InChI is InChI=1S/C22H31N3O2/c26-21(24-19-7-2-1-3-8-19)17-11-18(14-23-13-17)22(27)25-20-10-9-15-5-4-6-16(15)12-20/h9-10,12,17-19,23H,1-8,11,13-14H2,(H,24,26)(H,25,27)/t17-,18+/m0/s1.
What are the key properties of (3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide?
(3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide has a molecular weight of 369.51 g/mol, XLogP of 2.79, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,5R)-3-N-cyclohexyl-5-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3,5-dicarboxamide is sourced from PubChem (CID 56859378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).