9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride

C21H23ClN2O — CID 12923575

IUPAC9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride
SMILESCl.N#CC1(CCCN2CCOCC2)c2ccccc2-c2ccccc21
InChIInChI=1S/C21H22N2O.ClH/c22-16-21(10-5-11-23-12-14-24-15-13-23)19-8-3-1-6-17(19)18-7-2-4-9-20(18)21;/h1-4,6-9H,5,10-15H2;1H
InChIKeyDAYKMMOZZFTOGJ-UHFFFAOYSA-N
MW354.88 g/mol
LogP4.01
Rot. Bonds4

About 9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride

9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride (PubChem CID 12923575) has the molecular formula C21H23ClN2O and a molecular weight of 354.88 g/mol. Its IUPAC name is 9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride.

Molecular Properties

Compound Name9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride
PubChem CID12923575
Molecular FormulaC21H23ClN2O
Molecular Weight354.88 g/mol
Exact Mass354.15
IUPAC Name9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride
SMILESCl.N#CC1(CCCN2CCOCC2)c2ccccc2-c2ccccc21
InChIInChI=1S/C21H22N2O.ClH/c22-16-21(10-5-11-23-12-14-24-15-13-23)19-8-3-1-6-17(19)18-7-2-4-9-20(18)21;/h1-4,6-9H,5,10-15H2;1H
InChIKeyDAYKMMOZZFTOGJ-UHFFFAOYSA-N
XLogP4.01
TPSA36.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.88
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(2-{3-[1-Phenyl-meth-(E)-ylidene]-3H-inden-1-yl}-ethyl)-morpholine
CID 44350470
4-[2-[(3E)-3-[(2-phenylphenyl)methylidene]inden-1-yl]ethyl]morpholine
CID 72950876
4-[2-[(3E)-3-[(2-methylphenyl)methylidene]inden-1-yl]ethyl]morpholine
CID 118332422
Mls002638304
CID 224580
4-(Morpholin-4-yl)-2,2-diphenylbutanenitrile
CID 228568
1'-(Oxolan-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine];hydrochloride
CID 54586713
1-Naphthaleneacetonitrile, alpha-sec-butyl-alpha-(2-morpholinoethyl)-
CID 14713
2-Methyl-4-(morpholin-4-yl)-2-phenylbutanenitrile
CID 15022
1-Naphthaleneacetonitrile, alpha-methyl-alpha-(2-morpholinoethyl)-
CID 18120
Valeronitrile, 3-methyl-2-(2-morpholinoethyl)-2-phenyl-
CID 200909
Pentacynium Chloride
CID 10390947
3-Methyl-4-(morpholin-4-yl)-2,2-diphenylbutanenitrile
CID 224579

Frequently Asked Questions

What is the IUPAC name of 9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride?
The IUPAC name of 9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride (CID 12923575) is 9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride.
What is the SMILES notation for 9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride?
The canonical SMILES for 9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride is Cl.N#CC1(CCCN2CCOCC2)c2ccccc2-c2ccccc21.
What is the InChIKey of 9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride?
The InChIKey is DAYKMMOZZFTOGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O.ClH/c22-16-21(10-5-11-23-12-14-24-15-13-23)19-8-3-1-6-17(19)18-7-2-4-9-20(18)21;/h1-4,6-9H,5,10-15H2;1H.
What are the key properties of 9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride?
9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride has a molecular weight of 354.88 g/mol, XLogP of 4.01, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-morpholin-4-ylpropyl)fluorene-9-carbonitrile;hydrochloride is sourced from PubChem (CID 12923575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).