10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine

C30H23N3 — CID 59358485

IUPAC10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine
SMILESCCn1c2ccccc2c2cc(Cc3ccc4c(c3)c3ccccc3n3ccnc43)ccc21
InChIInChI=1S/C30H23N3/c1-2-32-27-9-5-4-8-23(27)26-19-21(12-14-29(26)32)17-20-11-13-24-25(18-20)22-7-3-6-10-28(22)33-16-15-31-30(24)33/h3-16,18-19H,2,17H2,1H3
InChIKeyWANCZNFUHSAMQB-UHFFFAOYSA-N
MW425.54 g/mol
LogP7.36
Rot. Bonds3

About 10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine

10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine (PubChem CID 59358485) has the molecular formula C30H23N3 and a molecular weight of 425.54 g/mol. Its IUPAC name is 10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine.

Molecular Properties

Compound Name10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine
PubChem CID59358485
Molecular FormulaC30H23N3
Molecular Weight425.54 g/mol
Exact Mass425.19
IUPAC Name10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine
SMILESCCn1c2ccccc2c2cc(Cc3ccc4c(c3)c3ccccc3n3ccnc43)ccc21
InChIInChI=1S/C30H23N3/c1-2-32-27-9-5-4-8-23(27)26-19-21(12-14-29(26)32)17-20-11-13-24-25(18-20)22-7-3-6-10-28(22)33-16-15-31-30(24)33/h3-16,18-19H,2,17H2,1H3
InChIKeyWANCZNFUHSAMQB-UHFFFAOYSA-N
XLogP7.36
TPSA22.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.54
LogP ≤ 57.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

4-[(9-ethylcarbazol-3-yl)methyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
CID 122537699
7-[(1-ethylcyclopentyl)methyl]imidazo[1,2-f]phenanthridine
CID 140585607
4-[(9-ethylcarbazol-3-yl)methyl]pyridine-2,3-diamine
CID 69354629
7,10-dimethylimidazo[1,2-f]phenanthridine
CID 58943988
9-ethyl-3-[(2,3,6-trifluorophenyl)methyl]carbazole
CID 91058956
7-butyl-10-tert-butylimidazo[1,2-f]phenanthridine
CID 153277944
9-ethyl-3-[(4-methylnaphthalen-1-yl)methyl]carbazole
CID 153374745
N,N-bis[(9-ethylcarbazol-3-yl)methyl]ethanamine
CID 160567842
3,6-diazapentacyclo[11.8.0.02,6.07,12.014,19]henicosa-1(13),2,4,7,9,11,14,16,18,20-decaene
CID 58162847
8-(9-ethylcarbazol-3-yl)-9-oxa-3-thia-1,5,13-triazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7,10,12,14-hexaene
CID 59358965
2-(9-ethylcarbazol-3-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 11110676
1-(9-ethylcarbazol-3-yl)propan-2-ol
CID 117386647

Frequently Asked Questions

What is the IUPAC name of 10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine?
The IUPAC name of 10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine (CID 59358485) is 10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine.
What is the SMILES notation for 10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine?
The canonical SMILES for 10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine is CCn1c2ccccc2c2cc(Cc3ccc4c(c3)c3ccccc3n3ccnc43)ccc21.
What is the InChIKey of 10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine?
The InChIKey is WANCZNFUHSAMQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H23N3/c1-2-32-27-9-5-4-8-23(27)26-19-21(12-14-29(26)32)17-20-11-13-24-25(18-20)22-7-3-6-10-28(22)33-16-15-31-30(24)33/h3-16,18-19H,2,17H2,1H3.
What are the key properties of 10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine?
10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine has a molecular weight of 425.54 g/mol, XLogP of 7.36, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[(9-ethylcarbazol-3-yl)methyl]imidazo[1,2-f]phenanthridine is sourced from PubChem (CID 59358485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).