N'-chloro-N-phenylfuran-2-carboximidamide

C11H9ClN2O — CID 163531531

IUPACN'-chloro-N-phenylfuran-2-carboximidamide
SMILESClN=C(Nc1ccccc1)c1ccco1
InChIInChI=1S/C11H9ClN2O/c12-14-11(10-7-4-8-15-10)13-9-5-2-1-3-6-9/h1-8H,(H,13,14)
InChIKeyDTKFHLKMQSDTBT-UHFFFAOYSA-N
MW220.66 g/mol
LogP3.29
Rot. Bonds2

About N'-chloro-N-phenylfuran-2-carboximidamide

N'-chloro-N-phenylfuran-2-carboximidamide (PubChem CID 163531531) has the molecular formula C11H9ClN2O and a molecular weight of 220.66 g/mol. Its IUPAC name is N'-chloro-N-phenylfuran-2-carboximidamide.

Molecular Properties

Compound NameN'-chloro-N-phenylfuran-2-carboximidamide
PubChem CID163531531
Molecular FormulaC11H9ClN2O
Molecular Weight220.66 g/mol
Exact Mass220.04
IUPAC NameN'-chloro-N-phenylfuran-2-carboximidamide
SMILESClN=C(Nc1ccccc1)c1ccco1
InChIInChI=1S/C11H9ClN2O/c12-14-11(10-7-4-8-15-10)13-9-5-2-1-3-6-9/h1-8H,(H,13,14)
InChIKeyDTKFHLKMQSDTBT-UHFFFAOYSA-N
XLogP3.29
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.66
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-cyclohexyl-N-phenylfuran-2-carboximidamide
CID 24838234
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
1-[(Z)-[(2Z)-1,2-bis(furan-2-yl)-2-(phenylcarbamothioylhydrazinylidene)ethylidene]amino]-3-phenylthiourea
CID 15682850
N-[4-[[[amino(anilino)methylidene]amino]methyl]phenyl]furan-2-carboxamide
CID 110917647
(2-anilino-2-oxoethyl) furan-2-carboxylate
CID 2352919
[4-(furan-2-carbonylamino)phenyl]carbamic acid
CID 18543126
2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-phenylacetamide
CID 773151
N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide
CID 9450262
N'-phenylfuran-2-carbothiohydrazide
CID 15761686
N-[4-(2-phenylethylcarbamoylamino)phenyl]furan-2-carboxamide
CID 38205482
[furan-2-yl(hydroxy)methylidene]chromium
CID 11728114
N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide
CID 2286846

Frequently Asked Questions

What is the IUPAC name of N'-chloro-N-phenylfuran-2-carboximidamide?
The IUPAC name of N'-chloro-N-phenylfuran-2-carboximidamide (CID 163531531) is N'-chloro-N-phenylfuran-2-carboximidamide.
What is the SMILES notation for N'-chloro-N-phenylfuran-2-carboximidamide?
The canonical SMILES for N'-chloro-N-phenylfuran-2-carboximidamide is ClN=C(Nc1ccccc1)c1ccco1.
What is the InChIKey of N'-chloro-N-phenylfuran-2-carboximidamide?
The InChIKey is DTKFHLKMQSDTBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O/c12-14-11(10-7-4-8-15-10)13-9-5-2-1-3-6-9/h1-8H,(H,13,14).
What are the key properties of N'-chloro-N-phenylfuran-2-carboximidamide?
N'-chloro-N-phenylfuran-2-carboximidamide has a molecular weight of 220.66 g/mol, XLogP of 3.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-chloro-N-phenylfuran-2-carboximidamide is sourced from PubChem (CID 163531531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).