5-methyl-6H-phosphanthridine

C14H13P — CID 144525107

IUPAC5-methyl-6H-phosphanthridine
SMILESCP1Cc2ccccc2-c2ccccc21
InChIInChI=1S/C14H13P/c1-15-10-11-6-2-3-7-12(11)13-8-4-5-9-14(13)15/h2-9H,10H2,1H3
InChIKeySNTAKNVPASACOA-UHFFFAOYSA-N
MW212.23 g/mol
LogP3.60
Rot. Bonds

About 5-methyl-6H-phosphanthridine

5-methyl-6H-phosphanthridine (PubChem CID 144525107) has the molecular formula C14H13P and a molecular weight of 212.23 g/mol. Its IUPAC name is 5-methyl-6H-phosphanthridine.

Molecular Properties

Compound Name5-methyl-6H-phosphanthridine
PubChem CID144525107
Molecular FormulaC14H13P
Molecular Weight212.23 g/mol
Exact Mass212.08
IUPAC Name5-methyl-6H-phosphanthridine
SMILESCP1Cc2ccccc2-c2ccccc21
InChIInChI=1S/C14H13P/c1-15-10-11-6-2-3-7-12(11)13-8-4-5-9-14(13)15/h2-9H,10H2,1H3
InChIKeySNTAKNVPASACOA-UHFFFAOYSA-N
XLogP3.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.23
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

9,10-dihydrophenanthrene;ethane
CID 143759681
6-(5,7-dihydrobenzo[d][2]benzophosphepin-6-ylmethyl)-5,7-dihydrobenzo[d][2]benzophosphepine
CID 19035171
azane;hexakis(9H-fluorene)
CID 158472914
azane;9H-fluorene;hydrobromide
CID 174352852
9,10-diselenatricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaene
CID 10947725
9,10-dihydrophenanthrene;methane
CID 174728506
cadmium;9H-fluorene
CID 175337736
9H-fluorene;trihydrofluoride
CID 172854917
tetracyclo[14.4.0.02,7.08,13]icosa-1(20),2,4,6,8,10,12,16,18-nonaene
CID 12568460
chromium;9H-fluorene
CID 161167703
1-methyl-3H-2,1-benzoxaphosphole
CID 178006597
acetic acid;azane;9H-fluorene
CID 174966259

Frequently Asked Questions

What is the IUPAC name of 5-methyl-6H-phosphanthridine?
The IUPAC name of 5-methyl-6H-phosphanthridine (CID 144525107) is 5-methyl-6H-phosphanthridine.
What is the SMILES notation for 5-methyl-6H-phosphanthridine?
The canonical SMILES for 5-methyl-6H-phosphanthridine is CP1Cc2ccccc2-c2ccccc21.
What is the InChIKey of 5-methyl-6H-phosphanthridine?
The InChIKey is SNTAKNVPASACOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13P/c1-15-10-11-6-2-3-7-12(11)13-8-4-5-9-14(13)15/h2-9H,10H2,1H3.
What are the key properties of 5-methyl-6H-phosphanthridine?
5-methyl-6H-phosphanthridine has a molecular weight of 212.23 g/mol, XLogP of 3.60, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6H-phosphanthridine is sourced from PubChem (CID 144525107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).