5,5-dimethyl-3H-1,10-phenanthroline

C14H14N2 — CID 57114855

IUPAC5,5-dimethyl-3H-1,10-phenanthroline
SMILESCC1(C)C=c2cccnc2=C2N=CCC=C21
InChIInChI=1S/C14H14N2/c1-14(2)9-10-5-3-7-15-12(10)13-11(14)6-4-8-16-13/h3,5-9H,4H2,1-2H3
InChIKeyYJQVNBWHNJSZFP-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.41
Rot. Bonds

About 5,5-dimethyl-3H-1,10-phenanthroline

5,5-dimethyl-3H-1,10-phenanthroline (PubChem CID 57114855) has the molecular formula C14H14N2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 5,5-dimethyl-3H-1,10-phenanthroline.

Molecular Properties

Compound Name5,5-dimethyl-3H-1,10-phenanthroline
PubChem CID57114855
Molecular FormulaC14H14N2
Molecular Weight210.28 g/mol
Exact Mass210.12
IUPAC Name5,5-dimethyl-3H-1,10-phenanthroline
SMILESCC1(C)C=c2cccnc2=C2N=CCC=C21
InChIInChI=1S/C14H14N2/c1-14(2)9-10-5-3-7-15-12(10)13-11(14)6-4-8-16-13/h3,5-9H,4H2,1-2H3
InChIKeyYJQVNBWHNJSZFP-UHFFFAOYSA-N
XLogP1.41
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7,7-Dimethylquinoline
CID 129752244
5,5-dimethyl-1H-1,10-phenanthroline
CID 21809444
1H-pyrido[4,3-b]carbazole
CID 21886950
1H-indolo[3,2-c]quinoline
CID 21887337
1H-pyrido[3,4-a]carbazole
CID 21887924
5,10-Diazatricyclo[9.4.0.01,6]pentadeca-2,4,6,9,11,13-hexaene
CID 57181186
4-methyl-8H-quinolin-8-ide;yttrium
CID 59017481
8-Methyl-6,7-dihydroquinoline
CID 66607842
(5R)-5,8-dimethyl-4a,5-dihydroquinoline
CID 68330516
3,3-dimethyl-9H-benzo[g]indol-9-ide;lawrencium
CID 70790261
3,6,6-trimethyl-7H-isoquinoline
CID 89038768
(7R)-7-methyl-6,7-dihydroquinoline
CID 89356030

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-3H-1,10-phenanthroline?
The IUPAC name of 5,5-dimethyl-3H-1,10-phenanthroline (CID 57114855) is 5,5-dimethyl-3H-1,10-phenanthroline.
What is the SMILES notation for 5,5-dimethyl-3H-1,10-phenanthroline?
The canonical SMILES for 5,5-dimethyl-3H-1,10-phenanthroline is CC1(C)C=c2cccnc2=C2N=CCC=C21.
What is the InChIKey of 5,5-dimethyl-3H-1,10-phenanthroline?
The InChIKey is YJQVNBWHNJSZFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2/c1-14(2)9-10-5-3-7-15-12(10)13-11(14)6-4-8-16-13/h3,5-9H,4H2,1-2H3.
What are the key properties of 5,5-dimethyl-3H-1,10-phenanthroline?
5,5-dimethyl-3H-1,10-phenanthroline has a molecular weight of 210.28 g/mol, XLogP of 1.41, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-3H-1,10-phenanthroline is sourced from PubChem (CID 57114855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).