4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine

C21H30N2O — CID 134077759

IUPAC4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine
SMILESc1ccc2c(c1)C(N1CCOCC1)CC21CCN(CC2CC2)CC1
InChIInChI=1S/C21H30N2O/c1-2-4-19-18(3-1)20(23-11-13-24-14-12-23)15-21(19)7-9-22(10-8-21)16-17-5-6-17/h1-4,17,20H,5-16H2
InChIKeyYWHJZZRGNMTICK-UHFFFAOYSA-N
MW326.48 g/mol
LogP3.21
Rot. Bonds3

About 4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine

4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine (PubChem CID 134077759) has the molecular formula C21H30N2O and a molecular weight of 326.48 g/mol. Its IUPAC name is 4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine.

Molecular Properties

Compound Name4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine
PubChem CID134077759
Molecular FormulaC21H30N2O
Molecular Weight326.48 g/mol
Exact Mass326.24
IUPAC Name4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine
SMILESc1ccc2c(c1)C(N1CCOCC1)CC21CCN(CC2CC2)CC1
InChIInChI=1S/C21H30N2O/c1-2-4-19-18(3-1)20(23-11-13-24-14-12-23)15-21(19)7-9-22(10-8-21)16-17-5-6-17/h1-4,17,20H,5-16H2
InChIKeyYWHJZZRGNMTICK-UHFFFAOYSA-N
XLogP3.21
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.48
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-carbonyl)cyclopropane-1-carbonitrile
CID 134078061
N-cyclobutyl-2-[(1R)-1'-(oxan-4-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 97375917
N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 131657389
2-[(1S)-1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-N,N-diethylacetamide
CID 97376186
N-(cyclopropylmethyl)-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 131645925
N-[1'-(oxolan-3-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]methanesulfonamide
CID 134073246
N-[(1S)-1'-(cyclopropylmethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-yl]acetamide
CID 59433199
N-[1'-(oxolan-3-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]ethanesulfonamide
CID 131654115
N-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-(dimethylamino)acetamide
CID 134077715
N-[(1S)-1'-(2-bicyclo[2.2.1]hept-5-enylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine-4-carboxamide
CID 58815582
1'-(cyclopropylmethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine];hydrochloride
CID 54586714
N-methyl-2-[1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]acetamide
CID 155901547

Frequently Asked Questions

What is the IUPAC name of 4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine?
The IUPAC name of 4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine (CID 134077759) is 4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine.
What is the SMILES notation for 4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine?
The canonical SMILES for 4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine is c1ccc2c(c1)C(N1CCOCC1)CC21CCN(CC2CC2)CC1.
What is the InChIKey of 4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine?
The InChIKey is YWHJZZRGNMTICK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N2O/c1-2-4-19-18(3-1)20(23-11-13-24-14-12-23)15-21(19)7-9-22(10-8-21)16-17-5-6-17/h1-4,17,20H,5-16H2.
What are the key properties of 4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine?
4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine has a molecular weight of 326.48 g/mol, XLogP of 3.21, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine is sourced from PubChem (CID 134077759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).