(3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine

C20H25N — CID 165004848

IUPAC(3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine
SMILESCC(C)c1ccc2cc3c(nc2c1)C[C@H](C1CCC1)CC3
InChIInChI=1S/C20H25N/c1-13(2)15-6-8-17-10-18-9-7-16(14-4-3-5-14)12-20(18)21-19(17)11-15/h6,8,10-11,13-14,16H,3-5,7,9,12H2,1-2H3/t16-/m1/s1
InChIKeyDZDMRCVQVVWKOD-MRXNPFEDSA-N
MW279.43 g/mol
LogP5.26
Rot. Bonds2

About (3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine

(3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine (PubChem CID 165004848) has the molecular formula C20H25N and a molecular weight of 279.43 g/mol. Its IUPAC name is (3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine.

Molecular Properties

Compound Name(3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine
PubChem CID165004848
Molecular FormulaC20H25N
Molecular Weight279.43 g/mol
Exact Mass279.20
IUPAC Name(3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine
SMILESCC(C)c1ccc2cc3c(nc2c1)C[C@H](C1CCC1)CC3
InChIInChI=1S/C20H25N/c1-13(2)15-6-8-17-10-18-9-7-16(14-4-3-5-14)12-20(18)21-19(17)11-15/h6,8,10-11,13-14,16H,3-5,7,9,12H2,1-2H3/t16-/m1/s1
InChIKeyDZDMRCVQVVWKOD-MRXNPFEDSA-N
XLogP5.26
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500279.43
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine with MolForge

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Related Compounds

(3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine
CID 165004844
(3S)-3-methyl-8-propan-2-yl-3,4-dihydro-1H-pyrano[3,4-b]quinoline
CID 165056031
8-propan-2-yl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[a]naphthalene
CID 58257789
benzene;7-propan-2-yl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline
CID 155732217
2,8-di(propan-2-yl)phenazine
CID 70800003
6-propan-2-yl-2,3-dihydropyrrolo[3,4-b]quinolin-1-one
CID 164969621
7-propan-2-ylspiro[1,3-dihydropyrrolo[2,3-b]quinoline-2,1'-cyclopropane]
CID 155362858
2-cyclopentyl-6-propan-2-ylindazole
CID 158645182
N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine
CID 141121657
2-iodo-7-propan-2-ylquinoline
CID 155701301
(2S)-6-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 55272655
(2R)-2,6-di(propan-2-yl)-1,2,3,4-tetrahydronaphthalene
CID 177260649

Frequently Asked Questions

What is the IUPAC name of (3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine?
The IUPAC name of (3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine (CID 165004848) is (3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine.
What is the SMILES notation for (3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine?
The canonical SMILES for (3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine is CC(C)c1ccc2cc3c(nc2c1)C[C@H](C1CCC1)CC3.
What is the InChIKey of (3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine?
The InChIKey is DZDMRCVQVVWKOD-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H25N/c1-13(2)15-6-8-17-10-18-9-7-16(14-4-3-5-14)12-20(18)21-19(17)11-15/h6,8,10-11,13-14,16H,3-5,7,9,12H2,1-2H3/t16-/m1/s1.
What are the key properties of (3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine?
(3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine has a molecular weight of 279.43 g/mol, XLogP of 5.26, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine is sourced from PubChem (CID 165004848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).