N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide

C14H16N2O2 — CID 112557315

IUPACN-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide
SMILESCCc1ccc(C(=O)Nc2cc(C)ccc2N)o1
InChIInChI=1S/C14H16N2O2/c1-3-10-5-7-13(18-10)14(17)16-12-8-9(2)4-6-11(12)15/h4-8H,3,15H2,1-2H3,(H,16,17)
InChIKeyDXCZIAVCZYEFDO-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.98
Rot. Bonds3

About N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide

N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide (PubChem CID 112557315) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide
PubChem CID112557315
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC NameN-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide
SMILESCCc1ccc(C(=O)Nc2cc(C)ccc2N)o1
InChIInChI=1S/C14H16N2O2/c1-3-10-5-7-13(18-10)14(17)16-12-8-9(2)4-6-11(12)15/h4-8H,3,15H2,1-2H3,(H,16,17)
InChIKeyDXCZIAVCZYEFDO-UHFFFAOYSA-N
XLogP2.98
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-ethyl-N-(2-hydroxy-4-methylphenyl)furan-2-carboxamide
CID 112726930
N-(4-amino-2-chlorophenyl)-5-ethylfuran-2-carboxamide
CID 79095779
N-(4-amino-2-methoxyphenyl)-5-ethylfuran-2-carboxamide
CID 79095434
5-ethyl-N-[5-(N'-hydroxycarbamimidoyl)-2-methylphenyl]furan-2-carboxamide
CID 79085708
4-[(5-ethylfuran-2-carbonyl)amino]-3-methylbenzoic acid
CID 43351217
N-(2-amino-4-methylphenyl)-5-methylfuran-2-carboxamide
CID 43259016
N-(3-bromo-5-methylphenyl)-5-ethylfuran-2-carboxamide
CID 104938590
5-ethyl-N-(3-iodo-2-methylphenyl)furan-2-carboxamide
CID 113368757
N-(4-amino-3-methoxyphenyl)-5-ethylfuran-2-carboxamide
CID 79094156
5-ethyl-N-methylfuran-2-carboxamide
CID 60751451
2-[(5-ethylfuran-2-carbonyl)amino]-5-fluorobenzoic acid
CID 43172269
4-[(5-ethylfuran-2-carbonyl)amino]-2-methyl-1H-pyrrole-3-carboxylic acid
CID 82880744

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide?
The IUPAC name of N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide (CID 112557315) is N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide.
What is the SMILES notation for N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide?
The canonical SMILES for N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide is CCc1ccc(C(=O)Nc2cc(C)ccc2N)o1.
What is the InChIKey of N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide?
The InChIKey is DXCZIAVCZYEFDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-3-10-5-7-13(18-10)14(17)16-12-8-9(2)4-6-11(12)15/h4-8H,3,15H2,1-2H3,(H,16,17).
What are the key properties of N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide?
N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide has a molecular weight of 244.29 g/mol, XLogP of 2.98, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide is sourced from PubChem (CID 112557315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).