N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide

C23H29N3O2 — CID 42365000

IUPACN-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide
SMILESCCC(=O)N[C@@H]1c2ccccc2C2(CCN(Cc3ccccn3)CC2)[C@H]1OC
InChIInChI=1S/C23H29N3O2/c1-3-20(27)25-21-18-9-4-5-10-19(18)23(22(21)28-2)11-14-26(15-12-23)16-17-8-6-7-13-24-17/h4-10,13,21-22H,3,11-12,14-16H2,1-2H3,(H,25,27)/t21-,22+/m1/s1
InChIKeyUPTYMKHEEANCKO-YADHBBJMSA-N
MW379.50 g/mol
LogP3.21
Rot. Bonds5

About N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide

N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide (PubChem CID 42365000) has the molecular formula C23H29N3O2 and a molecular weight of 379.50 g/mol. Its IUPAC name is N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide
PubChem CID42365000
Molecular FormulaC23H29N3O2
Molecular Weight379.50 g/mol
Exact Mass379.23
IUPAC NameN-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide
SMILESCCC(=O)N[C@@H]1c2ccccc2C2(CCN(Cc3ccccn3)CC2)[C@H]1OC
InChIInChI=1S/C23H29N3O2/c1-3-20(27)25-21-18-9-4-5-10-19(18)23(22(21)28-2)11-14-26(15-12-23)16-17-8-6-7-13-24-17/h4-10,13,21-22H,3,11-12,14-16H2,1-2H3,(H,25,27)/t21-,22+/m1/s1
InChIKeyUPTYMKHEEANCKO-YADHBBJMSA-N
XLogP3.21
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.50
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide?
The IUPAC name of N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide (CID 42365000) is N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide.
What is the SMILES notation for N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide?
The canonical SMILES for N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide is CCC(=O)N[C@@H]1c2ccccc2C2(CCN(Cc3ccccn3)CC2)[C@H]1OC.
What is the InChIKey of N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide?
The InChIKey is UPTYMKHEEANCKO-YADHBBJMSA-N. The full InChI is InChI=1S/C23H29N3O2/c1-3-20(27)25-21-18-9-4-5-10-19(18)23(22(21)28-2)11-14-26(15-12-23)16-17-8-6-7-13-24-17/h4-10,13,21-22H,3,11-12,14-16H2,1-2H3,(H,25,27)/t21-,22+/m1/s1.
What are the key properties of N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide?
N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide has a molecular weight of 379.50 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-methoxy-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propanamide is sourced from PubChem (CID 42365000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).