4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide

C15H16N2O3 — CID 107074444

IUPAC4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide
SMILESNc1ccc(C(=O)N(Cc2ccco2)C2CC2)cc1O
InChIInChI=1S/C15H16N2O3/c16-13-6-3-10(8-14(13)18)15(19)17(11-4-5-11)9-12-2-1-7-20-12/h1-3,6-8,11,18H,4-5,9,16H2
InChIKeyFWPNFRXGZULMPS-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.37
Rot. Bonds4

About 4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide

4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide (PubChem CID 107074444) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide
PubChem CID107074444
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide
SMILESNc1ccc(C(=O)N(Cc2ccco2)C2CC2)cc1O
InChIInChI=1S/C15H16N2O3/c16-13-6-3-10(8-14(13)18)15(19)17(11-4-5-11)9-12-2-1-7-20-12/h1-3,6-8,11,18H,4-5,9,16H2
InChIKeyFWPNFRXGZULMPS-UHFFFAOYSA-N
XLogP2.37
TPSA79.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

4-amino-3,5-dichloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzamide
CID 82811231
2-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-5-hydroxybenzamide
CID 107074445
N-cyclopropyl-N-(furan-2-ylmethyl)benzamide
CID 47022966
N-cyclopropyl-N-(furan-2-ylmethyl)-4-iodobenzamide
CID 60731680
N-cyclopropyl-N-(furan-2-ylmethyl)-3-methylbenzamide
CID 47022969
N-cyclopropyl-N-(furan-2-ylmethyl)-1H-indazole-6-carboxamide
CID 62905612
N-cyclopentyl-4-fluoro-N-(furan-2-ylmethyl)benzamide
CID 60737869
N-cyclopropyl-5-fluoro-N-(furan-2-ylmethyl)-2-hydroxybenzamide
CID 115299012
5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide
CID 81317098
N-cyclopentyl-N-(furan-2-ylmethyl)-1H-indole-6-carboxamide
CID 56797541
3-[cyclopropyl(furan-2-ylmethyl)carbamoyl]-1,2-oxazole-5-carboxylic acid
CID 107369452
N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide
CID 63860432

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide?
The IUPAC name of 4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide (CID 107074444) is 4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide.
What is the SMILES notation for 4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide?
The canonical SMILES for 4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide is Nc1ccc(C(=O)N(Cc2ccco2)C2CC2)cc1O.
What is the InChIKey of 4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide?
The InChIKey is FWPNFRXGZULMPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c16-13-6-3-10(8-14(13)18)15(19)17(11-4-5-11)9-12-2-1-7-20-12/h1-3,6-8,11,18H,4-5,9,16H2.
What are the key properties of 4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide?
4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide has a molecular weight of 272.30 g/mol, XLogP of 2.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide is sourced from PubChem (CID 107074444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).