N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide

C15H13N3O2 — CID 11277147

IUPACN-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide
SMILESNC(N)=NC(=O)c1ccc2c(c1)C(O)c1ccccc1-2
InChIInChI=1S/C15H13N3O2/c16-15(17)18-14(20)8-5-6-10-9-3-1-2-4-11(9)13(19)12(10)7-8/h1-7,13,19H,(H4,16,17,18,20)
InChIKeySLYGOZCZHBERQR-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.16
Rot. Bonds1

About N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide

N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide (PubChem CID 11277147) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide.

Molecular Properties

Compound NameN-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide
PubChem CID11277147
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC NameN-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide
SMILESNC(N)=NC(=O)c1ccc2c(c1)C(O)c1ccccc1-2
InChIInChI=1S/C15H13N3O2/c16-15(17)18-14(20)8-5-6-10-9-3-1-2-4-11(9)13(19)12(10)7-8/h1-7,13,19H,(H4,16,17,18,20)
InChIKeySLYGOZCZHBERQR-UHFFFAOYSA-N
XLogP1.16
TPSA101.70 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(diaminomethylidene)-9-hydroxy-5-methyl-9H-fluorene-2-carboxamide;hydrochloride
CID 118706281
N-(diaminomethylidene)-5-fluoro-9-hydroxy-9H-fluorene-2-carboxamide;hydrochloride
CID 118706283
8-chloro-N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide;hydrochloride
CID 118706288
N-(diaminomethylidene)-9-hydroxy-8-methyl-9H-fluorene-2-carboxamide;hydrochloride
CID 118706289
N-(diaminomethylidene)-5-ethyl-9-hydroxy-9-methylfluorene-2-carboxamide;hydrochloride
CID 118706733
N-(diaminomethylidene)-9-ethyl-9-methoxyfluorene-2-carboxamide;hydrochloride
CID 118717215
N-(diaminomethylidene)-9-methoxy-9-(methoxymethyl)fluorene-2-carboxamide;hydrochloride
CID 118717216
N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide;hydrochloride
CID 23151759
(9R)-N-(diaminomethylidene)spiro[fluorene-9,2'-oxolane]-2-carboxamide
CID 11536843
(9S)-N-(diaminomethylidene)spiro[fluorene-9,2'-oxolane]-2-carboxamide
CID 11536844
N-(diaminomethylidene)-9-hydroxy-9H-fluorene-3-carboxamide;hydrochloride
CID 72735039
(E)-N-(diaminomethylidene)-3-(9-hydroxy-9H-fluoren-2-yl)prop-2-enamide;hydrochloride
CID 72735041

Frequently Asked Questions

What is the IUPAC name of N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide?
The IUPAC name of N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide (CID 11277147) is N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide.
What is the SMILES notation for N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide?
The canonical SMILES for N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide is NC(N)=NC(=O)c1ccc2c(c1)C(O)c1ccccc1-2.
What is the InChIKey of N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide?
The InChIKey is SLYGOZCZHBERQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c16-15(17)18-14(20)8-5-6-10-9-3-1-2-4-11(9)13(19)12(10)7-8/h1-7,13,19H,(H4,16,17,18,20).
What are the key properties of N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide?
N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 1.16, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(diaminomethylidene)-9-hydroxy-9H-fluorene-2-carboxamide is sourced from PubChem (CID 11277147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).