1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol

C22H25NO — CID 86733946

IUPAC1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol
SMILESOc1cccc2c1Cc1ccccc1C21CCN(CC2CC2)CC1
InChIInChI=1S/C22H25NO/c24-21-7-3-6-20-18(21)14-17-4-1-2-5-19(17)22(20)10-12-23(13-11-22)15-16-8-9-16/h1-7,16,24H,8-15H2
InChIKeyGAKLJHHCPQEWCA-UHFFFAOYSA-N
MW319.45 g/mol
LogP4.09
Rot. Bonds2

About 1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol

1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol (PubChem CID 86733946) has the molecular formula C22H25NO and a molecular weight of 319.45 g/mol. Its IUPAC name is 1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol.

Molecular Properties

Compound Name1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol
PubChem CID86733946
Molecular FormulaC22H25NO
Molecular Weight319.45 g/mol
Exact Mass319.19
IUPAC Name1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol
SMILESOc1cccc2c1Cc1ccccc1C21CCN(CC2CC2)CC1
InChIInChI=1S/C22H25NO/c24-21-7-3-6-20-18(21)14-17-4-1-2-5-19(17)22(20)10-12-23(13-11-22)15-16-8-9-16/h1-7,16,24H,8-15H2
InChIKeyGAKLJHHCPQEWCA-UHFFFAOYSA-N
XLogP4.09
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.45
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1'-(cyclopropylmethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine];hydrochloride
CID 54586714
1-(cyclopropylmethyl)-4-phenylpiperidin-4-ol
CID 3064338
1'-benzylspiro[9H-anthracene-10,3'-pyrrolidine]-2-ol
CID 10337390
1'-(cyclopropylmethyl)spiro[1,3-dihydroindene-2,4'-piperidine]-1-ol
CID 141074704
2-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-ol
CID 105471672
1'-(cyclohexylmethyl)-2-methylspiro[3,4-dihydroisoquinoline-1,4'-piperidine]
CID 121359802
1'-(cyclopropylmethyl)spiro[3H-1-benzofuran-2,4'-piperidine]
CID 70607000
1-(cyclopropylmethyl)-4-methyl-4-(2-propylphenyl)piperidine
CID 138749021
ethane;1-spiro[9H-anthracene-10,4'-piperidine]-1'-ylethanone
CID 90873520
4-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]morpholine
CID 134077759
1'-(cyclopropylmethyl)-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one
CID 134788995
1'-(oxan-4-ylmethyl)spiro[3,4-dihydro-2H-isoquinoline-1,4'-piperidine]
CID 121359677

Frequently Asked Questions

What is the IUPAC name of 1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol?
The IUPAC name of 1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol (CID 86733946) is 1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol.
What is the SMILES notation for 1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol?
The canonical SMILES for 1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol is Oc1cccc2c1Cc1ccccc1C21CCN(CC2CC2)CC1.
What is the InChIKey of 1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol?
The InChIKey is GAKLJHHCPQEWCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25NO/c24-21-7-3-6-20-18(21)14-17-4-1-2-5-19(17)22(20)10-12-23(13-11-22)15-16-8-9-16/h1-7,16,24H,8-15H2.
What are the key properties of 1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol?
1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol has a molecular weight of 319.45 g/mol, XLogP of 4.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-(cyclopropylmethyl)spiro[9H-anthracene-10,4'-piperidine]-1-ol is sourced from PubChem (CID 86733946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).