(3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine

C17H21N — CID 165004844

IUPAC(3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine
SMILESCC(C)c1ccc2cc3c(nc2c1)C[C@@H](C)CC3
InChIInChI=1S/C17H21N/c1-11(2)13-6-7-15-9-14-5-4-12(3)8-16(14)18-17(15)10-13/h6-7,9-12H,4-5,8H2,1-3H3/t12-/m0/s1
InChIKeyYWNIOTBUUFNOQS-LBPRGKRZSA-N
MW239.36 g/mol
LogP4.48
Rot. Bonds1

About (3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine

(3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine (PubChem CID 165004844) has the molecular formula C17H21N and a molecular weight of 239.36 g/mol. Its IUPAC name is (3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine.

Molecular Properties

Compound Name(3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine
PubChem CID165004844
Molecular FormulaC17H21N
Molecular Weight239.36 g/mol
Exact Mass239.17
IUPAC Name(3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine
SMILESCC(C)c1ccc2cc3c(nc2c1)C[C@@H](C)CC3
InChIInChI=1S/C17H21N/c1-11(2)13-6-7-15-9-14-5-4-12(3)8-16(14)18-17(15)10-13/h6-7,9-12H,4-5,8H2,1-3H3/t12-/m0/s1
InChIKeyYWNIOTBUUFNOQS-LBPRGKRZSA-N
XLogP4.48
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(3R)-3-cyclobutyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine
CID 165004848
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benzene;7-propan-2-yl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline
CID 155732217
7-propan-2-ylspiro[1,3-dihydropyrrolo[2,3-b]quinoline-2,1'-cyclopropane]
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6-propan-2-yl-2,3-dihydropyrrolo[3,4-b]quinolin-1-one
CID 164969621
7-methyl-6,7,8,9-tetrahydrobenzo[g]quinoline
CID 169264544
2-cyclopentyl-6-propan-2-ylindazole
CID 158645182
2-iodo-7-propan-2-ylquinoline
CID 155701301
2,8-di(propan-2-yl)phenazine
CID 70800003
N-phenyl-7-propan-2-ylquinolin-2-amine
CID 126500193
(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 (3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine?
The IUPAC name of (3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine (CID 165004844) is (3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine.
What is the SMILES notation for (3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine?
The canonical SMILES for (3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine is CC(C)c1ccc2cc3c(nc2c1)C[C@@H](C)CC3.
What is the InChIKey of (3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine?
The InChIKey is YWNIOTBUUFNOQS-LBPRGKRZSA-N. The full InChI is InChI=1S/C17H21N/c1-11(2)13-6-7-15-9-14-5-4-12(3)8-16(14)18-17(15)10-13/h6-7,9-12H,4-5,8H2,1-3H3/t12-/m0/s1.
What are the key properties of (3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine?
(3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine has a molecular weight of 239.36 g/mol, XLogP of 4.48, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-methyl-6-propan-2-yl-1,2,3,4-tetrahydroacridine is sourced from PubChem (CID 165004844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).