N-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide

C15H15N3O4 — CID 6009222

IUPACN-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide
SMILESC/C(=N/NC(=O)c1ccco1)c1ccc(OCC(N)=O)cc1
InChIInChI=1S/C15H15N3O4/c1-10(17-18-15(20)13-3-2-8-21-13)11-4-6-12(7-5-11)22-9-14(16)19/h2-8H,9H2,1H3,(H2,16,19)(H,18,20)/b17-10-
InChIKeyHYUVONSLXKHXIZ-YVLHZVERSA-N
MW301.30 g/mol
LogP1.30
Rot. Bonds6

About N-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide

N-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide (PubChem CID 6009222) has the molecular formula C15H15N3O4 and a molecular weight of 301.30 g/mol. Its IUPAC name is N-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide
PubChem CID6009222
Molecular FormulaC15H15N3O4
Molecular Weight301.30 g/mol
Exact Mass301.11
IUPAC NameN-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide
SMILESC/C(=N/NC(=O)c1ccco1)c1ccc(OCC(N)=O)cc1
InChIInChI=1S/C15H15N3O4/c1-10(17-18-15(20)13-3-2-8-21-13)11-4-6-12(7-5-11)22-9-14(16)19/h2-8H,9H2,1H3,(H2,16,19)(H,18,20)/b17-10-
InChIKeyHYUVONSLXKHXIZ-YVLHZVERSA-N
XLogP1.30
TPSA106.92 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.30
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide
CID 9175372
N-[1-(4-methylphenyl)ethylideneamino]furan-2-carboxamide
CID 5087593
N-[(E)-1-(4-bromophenyl)ethylideneamino]furan-2-carboxamide
CID 5340021
N-[1-(4-phenylphenyl)ethylideneamino]furan-2-carboxamide
CID 761397
N-[(E)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]-5-ethylthiophene-3-carboxamide
CID 17126701
N-[1-(3,4-dimethoxyphenyl)ethylideneamino]furan-2-carboxamide
CID 760187
N-[1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]-4-pyrrol-1-ylbenzamide
CID 4590770
N-[(E)-1-(furan-2-yl)ethylideneamino]furan-2-carboxamide
CID 5339845
N-[(E)-1-naphthalen-2-ylethylideneamino]furan-2-carboxamide
CID 7460942
N-[(Z)-1-(4-pentylphenyl)ethylideneamino]furan-2-carboxamide
CID 6105123
N-[1-(4-nitrophenyl)ethylideneamino]furan-2-carboxamide
CID 760185
[2-(furan-2-carbonylamino)-2-oxoethyl] 2-(4-acetylphenoxy)acetate
CID 24558117

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide?
The IUPAC name of N-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide (CID 6009222) is N-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide.
What is the SMILES notation for N-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide?
The canonical SMILES for N-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide is C/C(=N/NC(=O)c1ccco1)c1ccc(OCC(N)=O)cc1.
What is the InChIKey of N-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide?
The InChIKey is HYUVONSLXKHXIZ-YVLHZVERSA-N. The full InChI is InChI=1S/C15H15N3O4/c1-10(17-18-15(20)13-3-2-8-21-13)11-4-6-12(7-5-11)22-9-14(16)19/h2-8H,9H2,1H3,(H2,16,19)(H,18,20)/b17-10-.
What are the key properties of N-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide?
N-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide has a molecular weight of 301.30 g/mol, XLogP of 1.30, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-[4-(2-amino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide is sourced from PubChem (CID 6009222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).