N-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide

C19H14N2O2 — CID 801146

IUPACN-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide
SMILESCc1occc1C(=O)NN=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C19H14N2O2/c1-12-13(10-11-23-12)19(22)21-20-18-16-8-4-2-6-14(16)15-7-3-5-9-17(15)18/h2-11H,1H3,(H,21,22)
InChIKeySGXRAKJYJXWQAH-UHFFFAOYSA-N
MW302.33 g/mol
LogP3.75
Rot. Bonds2

About N-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide

N-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide (PubChem CID 801146) has the molecular formula C19H14N2O2 and a molecular weight of 302.33 g/mol. Its IUPAC name is N-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide
PubChem CID801146
Molecular FormulaC19H14N2O2
Molecular Weight302.33 g/mol
Exact Mass302.11
IUPAC NameN-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide
SMILESCc1occc1C(=O)NN=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C19H14N2O2/c1-12-13(10-11-23-12)19(22)21-20-18-16-8-4-2-6-14(16)15-7-3-5-9-17(15)18/h2-11H,1H3,(H,21,22)
InChIKeySGXRAKJYJXWQAH-UHFFFAOYSA-N
XLogP3.75
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-methyl-N-[[phenyl-(4-phenylphenyl)methylidene]amino]furan-3-carboxamide
CID 5016586
N-[(Z)-(2-fluorophenyl)methylideneamino]-2-methylfuran-3-carboxamide
CID 5402053
N-iodo-2-methylfuran-3-carboxamide
CID 170236265
N-[(1-ethylpiperidin-4-ylidene)amino]-2-methylfuran-3-carboxamide
CID 3642312
1-N',4-N'-bis(2-methylfuran-3-carbonyl)benzene-1,4-dicarbohydrazide
CID 1011836
N-[(E)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-2-methylfuran-3-carboxamide
CID 6879712
2-methyl-N-[(Z)-naphthalen-1-ylmethylideneamino]furan-3-carboxamide
CID 5402054
N-[(Z)-(4-hydroxyphenyl)methylideneamino]-2-methylfuran-3-carboxamide
CID 135781724
N-[(E)-[1-(2-hydroxyphenyl)-3-phenylpropylidene]amino]-2-methylfuran-3-carboxamide
CID 135576103
N-[(2-ethylcyclopentylidene)amino]-2-methylfuran-3-carboxamide
CID 3716947
N-(benzenesulfonyl)-2-methylfuran-3-carboxamide
CID 47231856
2-[(2-methylfuran-3-carbonyl)amino]benzoate
CID 2225644

Frequently Asked Questions

What is the IUPAC name of N-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide?
The IUPAC name of N-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide (CID 801146) is N-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide?
The canonical SMILES for N-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide is Cc1occc1C(=O)NN=C1c2ccccc2-c2ccccc21.
What is the InChIKey of N-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide?
The InChIKey is SGXRAKJYJXWQAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O2/c1-12-13(10-11-23-12)19(22)21-20-18-16-8-4-2-6-14(16)15-7-3-5-9-17(15)18/h2-11H,1H3,(H,21,22).
What are the key properties of N-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide?
N-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide has a molecular weight of 302.33 g/mol, XLogP of 3.75, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(fluoren-9-ylideneamino)-2-methylfuran-3-carboxamide is sourced from PubChem (CID 801146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).