1,8-dihydrobenzo[lmn]phenanthridine

C15H11N — CID 163818465

IUPAC1,8-dihydrobenzo[lmn]phenanthridine
SMILESC1=Cc2cnc3c4c(ccc(c24)C1)CC=C3
InChIInChI=1S/C15H11N/c1-3-10-7-8-11-4-2-6-13-15(11)14(10)12(5-1)9-16-13/h1-2,5-9H,3-4H2
InChIKeyNVCPZWPPZSZOIA-UHFFFAOYSA-N
MW205.26 g/mol
LogP3.37
Rot. Bonds

About 1,8-dihydrobenzo[lmn]phenanthridine

1,8-dihydrobenzo[lmn]phenanthridine (PubChem CID 163818465) has the molecular formula C15H11N and a molecular weight of 205.26 g/mol. Its IUPAC name is 1,8-dihydrobenzo[lmn]phenanthridine.

Molecular Properties

Compound Name1,8-dihydrobenzo[lmn]phenanthridine
PubChem CID163818465
Molecular FormulaC15H11N
Molecular Weight205.26 g/mol
Exact Mass205.09
IUPAC Name1,8-dihydrobenzo[lmn]phenanthridine
SMILESC1=Cc2cnc3c4c(ccc(c24)C1)CC=C3
InChIInChI=1S/C15H11N/c1-3-10-7-8-11-4-2-6-13-15(11)14(10)12(5-1)9-16-13/h1-2,5-9H,3-4H2
InChIKeyNVCPZWPPZSZOIA-UHFFFAOYSA-N
XLogP3.37
TPSA12.89 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 ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,8-dihydrobenzo[lmn]phenanthridine?
The IUPAC name of 1,8-dihydrobenzo[lmn]phenanthridine (CID 163818465) is 1,8-dihydrobenzo[lmn]phenanthridine.
What is the SMILES notation for 1,8-dihydrobenzo[lmn]phenanthridine?
The canonical SMILES for 1,8-dihydrobenzo[lmn]phenanthridine is C1=Cc2cnc3c4c(ccc(c24)C1)CC=C3.
What is the InChIKey of 1,8-dihydrobenzo[lmn]phenanthridine?
The InChIKey is NVCPZWPPZSZOIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N/c1-3-10-7-8-11-4-2-6-13-15(11)14(10)12(5-1)9-16-13/h1-2,5-9H,3-4H2.
What are the key properties of 1,8-dihydrobenzo[lmn]phenanthridine?
1,8-dihydrobenzo[lmn]phenanthridine has a molecular weight of 205.26 g/mol, XLogP of 3.37, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-dihydrobenzo[lmn]phenanthridine is sourced from PubChem (CID 163818465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).