N,N'-diaminofuran-2-carboximidamide

C5H8N4O — CID 145191959

IUPACN,N'-diaminofuran-2-carboximidamide
SMILESN/N=C(\NN)c1ccco1
InChIInChI=1S/C5H8N4O/c6-8-5(9-7)4-2-1-3-10-4/h1-3H,6-7H2,(H,8,9)
InChIKeyQEZDLNIBPRGVIE-UHFFFAOYSA-N
MW140.15 g/mol
LogP-0.64
Rot. Bonds1

About N,N'-diaminofuran-2-carboximidamide

N,N'-diaminofuran-2-carboximidamide (PubChem CID 145191959) has the molecular formula C5H8N4O and a molecular weight of 140.15 g/mol. Its IUPAC name is N,N'-diaminofuran-2-carboximidamide.

Molecular Properties

Compound NameN,N'-diaminofuran-2-carboximidamide
PubChem CID145191959
Molecular FormulaC5H8N4O
Molecular Weight140.15 g/mol
Exact Mass140.07
IUPAC NameN,N'-diaminofuran-2-carboximidamide
SMILESN/N=C(\NN)c1ccco1
InChIInChI=1S/C5H8N4O/c6-8-5(9-7)4-2-1-3-10-4/h1-3H,6-7H2,(H,8,9)
InChIKeyQEZDLNIBPRGVIE-UHFFFAOYSA-N
XLogP-0.64
TPSA89.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.15
LogP ≤ 5-0.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N'-diaminofuran-2-carboximidamide;ethane
CID 145191958
N'-chloro-N-phenylfuran-2-carboximidamide
CID 163531531
bis((NZ)-N-[(2Z)-1,2-bis(furan-2-yl)-2-hydroxyiminoethylidene]hydroxylamine);copper
CID 135436493
N-(diaminomethylideneamino)furan-2-carboxamide
CID 15761647
bromomethyl furan-2-carboxylate
CID 54363056
furan-2-carboxamide;molecular hydrogen
CID 145259960
furan-2-carboxylic acid;methanamine
CID 82372767
[furan-2-yl(hydroxy)methylidene]chromium
CID 11728114
N,N'-diamino-2-[3-chloro-4-(furan-2-yl)benzoyl]cyclopropene-1-carboximidamide
CID 137117444
(1E,3Z)-1-chloro-4-(furan-2-yl)buta-1,3-diene-1,4-diamine
CID 178014645
3-amino-3-(furan-2-yl)prop-2-enenitrile
CID 69283548
[(Z)-1-(furan-2-yl)ethylideneamino]urea
CID 5354823

Frequently Asked Questions

What is the IUPAC name of N,N'-diaminofuran-2-carboximidamide?
The IUPAC name of N,N'-diaminofuran-2-carboximidamide (CID 145191959) is N,N'-diaminofuran-2-carboximidamide.
What is the SMILES notation for N,N'-diaminofuran-2-carboximidamide?
The canonical SMILES for N,N'-diaminofuran-2-carboximidamide is N/N=C(\NN)c1ccco1.
What is the InChIKey of N,N'-diaminofuran-2-carboximidamide?
The InChIKey is QEZDLNIBPRGVIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4O/c6-8-5(9-7)4-2-1-3-10-4/h1-3H,6-7H2,(H,8,9).
What are the key properties of N,N'-diaminofuran-2-carboximidamide?
N,N'-diaminofuran-2-carboximidamide has a molecular weight of 140.15 g/mol, XLogP of -0.64, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-diaminofuran-2-carboximidamide is sourced from PubChem (CID 145191959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).