N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide

C21H29N3O3 — CID 131653154

IUPACN,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide
SMILESCN(C)C(=O)N1CCC2(CC1)CC(NC(=O)[C@H]1CCCO1)c1ccccc12
InChIInChI=1S/C21H29N3O3/c1-23(2)20(26)24-11-9-21(10-12-24)14-17(15-6-3-4-7-16(15)21)22-19(25)18-8-5-13-27-18/h3-4,6-7,17-18H,5,8-14H2,1-2H3,(H,22,25)/t17?,18-/m1/s1
InChIKeyUOPUINCPOLQYPO-QRWMCTBCSA-N
MW371.48 g/mol
LogP2.44
Rot. Bonds2

About N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide

N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide (PubChem CID 131653154) has the molecular formula C21H29N3O3 and a molecular weight of 371.48 g/mol. Its IUPAC name is N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide
PubChem CID131653154
Molecular FormulaC21H29N3O3
Molecular Weight371.48 g/mol
Exact Mass371.22
IUPAC NameN,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide
SMILESCN(C)C(=O)N1CCC2(CC1)CC(NC(=O)[C@H]1CCCO1)c1ccccc12
InChIInChI=1S/C21H29N3O3/c1-23(2)20(26)24-11-9-21(10-12-24)14-17(15-6-3-4-7-16(15)21)22-19(25)18-8-5-13-27-18/h3-4,6-7,17-18H,5,8-14H2,1-2H3,(H,22,25)/t17?,18-/m1/s1
InChIKeyUOPUINCPOLQYPO-QRWMCTBCSA-N
XLogP2.44
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.48
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide with MolForge

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Related Compounds

N-[(1S)-1'-(3,3-dimethylbutyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-yl]oxolane-2-carboxamide;molecular hydrogen
CID 162068259
1-[2-(cyclobutylamino)-2-oxoethyl]-N,N-dimethylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide
CID 131661630
(1S)-1-[2-(cyclopropylamino)-2-oxoethyl]-N,N-dimethylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide
CID 97376139
(2R)-N-[(4R)-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-yl]oxolane-2-carboxamide
CID 51494028
N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-yloxolane-2-carboxamide
CID 46958893
(1R)-N,N-dimethyl-1-[2-oxo-2-(propan-2-ylamino)ethyl]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide
CID 97375787
1-(1'-benzoylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)-3-propan-2-ylurea
CID 134790690
[(2S)-oxolan-2-yl]-(1-pyrimidin-5-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone
CID 133141048
N-[(1R)-1'-[2-(dimethylamino)-2-oxoethyl]spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methylpropanamide
CID 97400190
N,N-dimethyl-2-oxo-1-(oxolan-2-ylmethyl)spiro[3H-quinoline-4,4'-piperidine]-1'-carboxamide
CID 134076312
3-[(1S)-1'-(cyclopentylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-1,1-di(propan-2-yl)urea
CID 59433056
1,1-dimethyl-3-[(1S)-1'-(3-methylbutyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]urea;molecular hydrogen
CID 157245167

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide?
The IUPAC name of N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide (CID 131653154) is N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide?
The canonical SMILES for N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide is CN(C)C(=O)N1CCC2(CC1)CC(NC(=O)[C@H]1CCCO1)c1ccccc12.
What is the InChIKey of N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide?
The InChIKey is UOPUINCPOLQYPO-QRWMCTBCSA-N. The full InChI is InChI=1S/C21H29N3O3/c1-23(2)20(26)24-11-9-21(10-12-24)14-17(15-6-3-4-7-16(15)21)22-19(25)18-8-5-13-27-18/h3-4,6-7,17-18H,5,8-14H2,1-2H3,(H,22,25)/t17?,18-/m1/s1.
What are the key properties of N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide?
N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide has a molecular weight of 371.48 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[[(2R)-oxolane-2-carbonyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide is sourced from PubChem (CID 131653154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).