2-(9-phenylcarbazol-4-yl)acetic acid

C20H15NO2 — CID 154200316

IUPAC2-(9-phenylcarbazol-4-yl)acetic acid
SMILESO=C(O)Cc1cccc2c1c1ccccc1n2-c1ccccc1
InChIInChI=1S/C20H15NO2/c22-19(23)13-14-7-6-12-18-20(14)16-10-4-5-11-17(16)21(18)15-8-2-1-3-9-15/h1-12H,13H2,(H,22,23)
InChIKeySPDKWXBLGBEJSF-UHFFFAOYSA-N
MW301.35 g/mol
LogP4.41
Rot. Bonds3

About 2-(9-phenylcarbazol-4-yl)acetic acid

2-(9-phenylcarbazol-4-yl)acetic acid (PubChem CID 154200316) has the molecular formula C20H15NO2 and a molecular weight of 301.35 g/mol. Its IUPAC name is 2-(9-phenylcarbazol-4-yl)acetic acid.

Molecular Properties

Compound Name2-(9-phenylcarbazol-4-yl)acetic acid
PubChem CID154200316
Molecular FormulaC20H15NO2
Molecular Weight301.35 g/mol
Exact Mass301.11
IUPAC Name2-(9-phenylcarbazol-4-yl)acetic acid
SMILESO=C(O)Cc1cccc2c1c1ccccc1n2-c1ccccc1
InChIInChI=1S/C20H15NO2/c22-19(23)13-14-7-6-12-18-20(14)16-10-4-5-11-17(16)21(18)15-8-2-1-3-9-15/h1-12H,13H2,(H,22,23)
InChIKeySPDKWXBLGBEJSF-UHFFFAOYSA-N
XLogP4.41
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-bromo-1-phenylindol-2-yl)acetic acid
CID 70874542
4-iodo-9-phenylcarbazole
CID 126592391
(9-phenylcarbazol-4-yl)boronic acid
CID 90057429
ethane;(9-phenylcarbazol-4-yl)boronic acid
CID 178110282
9-phenyl-14-[10-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)anthracen-9-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 170394033
4-(4-fluoranthen-3-ylnaphthalen-1-yl)-9-phenylcarbazole
CID 122434619
9-[3-(3-carbazol-9-ylphenyl)phenyl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 134168669
9-phenyl-4-pyrrol-1-ylcarbazole
CID 168863070
5,12-diphenylindolo[3,2-c]carbazole
CID 22105108
9-phenyl-4-[10-(9-phenylcarbazol-4-yl)perylen-3-yl]carbazole
CID 171428659
9-(4-ethylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 118689637
9-phenylcarbazole-4-carboximidamide
CID 142504972

Frequently Asked Questions

What is the IUPAC name of 2-(9-phenylcarbazol-4-yl)acetic acid?
The IUPAC name of 2-(9-phenylcarbazol-4-yl)acetic acid (CID 154200316) is 2-(9-phenylcarbazol-4-yl)acetic acid.
What is the SMILES notation for 2-(9-phenylcarbazol-4-yl)acetic acid?
The canonical SMILES for 2-(9-phenylcarbazol-4-yl)acetic acid is O=C(O)Cc1cccc2c1c1ccccc1n2-c1ccccc1.
What is the InChIKey of 2-(9-phenylcarbazol-4-yl)acetic acid?
The InChIKey is SPDKWXBLGBEJSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO2/c22-19(23)13-14-7-6-12-18-20(14)16-10-4-5-11-17(16)21(18)15-8-2-1-3-9-15/h1-12H,13H2,(H,22,23).
What are the key properties of 2-(9-phenylcarbazol-4-yl)acetic acid?
2-(9-phenylcarbazol-4-yl)acetic acid has a molecular weight of 301.35 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9-phenylcarbazol-4-yl)acetic acid is sourced from PubChem (CID 154200316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).