9,10-dihydrophenanthrene-2-carbonitrile

C15H11N — CID 141332736

IUPAC9,10-dihydrophenanthrene-2-carbonitrile
SMILESN#Cc1ccc2c(c1)CCc1ccccc1-2
InChIInChI=1S/C15H11N/c16-10-11-5-8-15-13(9-11)7-6-12-3-1-2-4-14(12)15/h1-5,8-9H,6-7H2
InChIKeyCLFNNDMVSJCDLC-UHFFFAOYSA-N
MW205.26 g/mol
LogP3.32
Rot. Bonds

About 9,10-dihydrophenanthrene-2-carbonitrile

9,10-dihydrophenanthrene-2-carbonitrile (PubChem CID 141332736) has the molecular formula C15H11N and a molecular weight of 205.26 g/mol. Its IUPAC name is 9,10-dihydrophenanthrene-2-carbonitrile.

Molecular Properties

Compound Name9,10-dihydrophenanthrene-2-carbonitrile
PubChem CID141332736
Molecular FormulaC15H11N
Molecular Weight205.26 g/mol
Exact Mass205.09
IUPAC Name9,10-dihydrophenanthrene-2-carbonitrile
SMILESN#Cc1ccc2c(c1)CCc1ccccc1-2
InChIInChI=1S/C15H11N/c16-10-11-5-8-15-13(9-11)7-6-12-3-1-2-4-14(12)15/h1-5,8-9H,6-7H2
InChIKeyCLFNNDMVSJCDLC-UHFFFAOYSA-N
XLogP3.32
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9,10-dihydrophenanthrene;methane
CID 174728506
tetracyclo[14.4.0.02,7.08,13]icosa-1(20),2,4,6,8,10,12,16,18-nonaene
CID 12568460
tricyclo[10.4.0.04,9]hexadeca-1(12),4(9),5,7,13,15-hexaen-10-yne-6,15-dicarbonitrile
CID 102170033
1-(methoxymethylidene)-2,3-dihydroindene-5-carbonitrile
CID 86071681
9,10-dihydrophenanthrene;ethane
CID 143759681
9,10-dioxoanthracene-2-carbonitrile
CID 13182761
1-oxo-3H-2-benzofuran-5-carbonitrile
CID 821218
tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,9,11,13-heptaene-5-carbonitrile
CID 152766237
9-oxofluorene-3-carbonitrile
CID 1237535
9,10-dihydrophenanthren-2-ol;ethane
CID 91093084
18-methylpentacyclo[21.4.0.02,7.09,14.015,20]heptacosa-1(27),2,4,6,9,11,13,15(20),16,18,23,25-dodecaene
CID 143650268
(S)-N-(5-cyano-2,3-dihydroinden-1-ylidene)-2-methylpropane-2-sulfinamide
CID 164874982

Frequently Asked Questions

What is the IUPAC name of 9,10-dihydrophenanthrene-2-carbonitrile?
The IUPAC name of 9,10-dihydrophenanthrene-2-carbonitrile (CID 141332736) is 9,10-dihydrophenanthrene-2-carbonitrile.
What is the SMILES notation for 9,10-dihydrophenanthrene-2-carbonitrile?
The canonical SMILES for 9,10-dihydrophenanthrene-2-carbonitrile is N#Cc1ccc2c(c1)CCc1ccccc1-2.
What is the InChIKey of 9,10-dihydrophenanthrene-2-carbonitrile?
The InChIKey is CLFNNDMVSJCDLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N/c16-10-11-5-8-15-13(9-11)7-6-12-3-1-2-4-14(12)15/h1-5,8-9H,6-7H2.
What are the key properties of 9,10-dihydrophenanthrene-2-carbonitrile?
9,10-dihydrophenanthrene-2-carbonitrile has a molecular weight of 205.26 g/mol, XLogP of 3.32, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-dihydrophenanthrene-2-carbonitrile is sourced from PubChem (CID 141332736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).