2-(dibenzofuran-3-carbonylamino)acetic acid

C15H11NO4 — CID 169199306

IUPAC2-(dibenzofuran-3-carbonylamino)acetic acid
SMILESO=C(O)CNC(=O)c1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C15H11NO4/c17-14(18)8-16-15(19)9-5-6-11-10-3-1-2-4-12(10)20-13(11)7-9/h1-7H,8H2,(H,16,19)(H,17,18)
InChIKeyIXWXRFKVDJLQQO-UHFFFAOYSA-N
MW269.26 g/mol
LogP2.40
Rot. Bonds3

About 2-(dibenzofuran-3-carbonylamino)acetic acid

2-(dibenzofuran-3-carbonylamino)acetic acid (PubChem CID 169199306) has the molecular formula C15H11NO4 and a molecular weight of 269.26 g/mol. Its IUPAC name is 2-(dibenzofuran-3-carbonylamino)acetic acid.

Molecular Properties

Compound Name2-(dibenzofuran-3-carbonylamino)acetic acid
PubChem CID169199306
Molecular FormulaC15H11NO4
Molecular Weight269.26 g/mol
Exact Mass269.07
IUPAC Name2-(dibenzofuran-3-carbonylamino)acetic acid
SMILESO=C(O)CNC(=O)c1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C15H11NO4/c17-14(18)8-16-15(19)9-5-6-11-10-3-1-2-4-12(10)20-13(11)7-9/h1-7H,8H2,(H,16,19)(H,17,18)
InChIKeyIXWXRFKVDJLQQO-UHFFFAOYSA-N
XLogP2.40
TPSA79.54 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

dibenzofuran-3-carboxylate
CID 51860493
N-propyldibenzofuran-2-carboxamide
CID 19048225
2-[[(2S)-3-dibenzofuran-3-yl-2-(phosphonomethylamino)propanoyl]amino]acetic acid
CID 10645007
2-benzamidoacetic acid;hydrofluoride
CID 174760685
2-[(4-hydroxy-[1]benzofuro[3,2-c]pyridine-3-carbonyl)amino]acetic acid
CID 42639237
2-[(9,10-dioxoanthracene-2-carbonyl)amino]acetic acid
CID 10380616
carbon dioxide;9-oxoxanthene-3-carboxylic acid
CID 158563906
N-dibenzofuran-3-yl-3,4-dimethylbenzamide
CID 3259661
4-(carboxymethylcarbamoyl)benzoic acid
CID 166957862
N-naphthalen-1-yldibenzofuran-2-carboxamide
CID 18876147
bis(2-aminoacetic acid);2-benzamidoacetic acid
CID 175296236
N-dibenzofuran-3-yl-3,4-diethoxybenzamide
CID 100535304

Frequently Asked Questions

What is the IUPAC name of 2-(dibenzofuran-3-carbonylamino)acetic acid?
The IUPAC name of 2-(dibenzofuran-3-carbonylamino)acetic acid (CID 169199306) is 2-(dibenzofuran-3-carbonylamino)acetic acid.
What is the SMILES notation for 2-(dibenzofuran-3-carbonylamino)acetic acid?
The canonical SMILES for 2-(dibenzofuran-3-carbonylamino)acetic acid is O=C(O)CNC(=O)c1ccc2c(c1)oc1ccccc12.
What is the InChIKey of 2-(dibenzofuran-3-carbonylamino)acetic acid?
The InChIKey is IXWXRFKVDJLQQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO4/c17-14(18)8-16-15(19)9-5-6-11-10-3-1-2-4-12(10)20-13(11)7-9/h1-7H,8H2,(H,16,19)(H,17,18).
What are the key properties of 2-(dibenzofuran-3-carbonylamino)acetic acid?
2-(dibenzofuran-3-carbonylamino)acetic acid has a molecular weight of 269.26 g/mol, XLogP of 2.40, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dibenzofuran-3-carbonylamino)acetic acid is sourced from PubChem (CID 169199306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).