5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide

C15H18N2O3 — CID 91687714

IUPAC5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide
SMILESCOCCCNC(=O)c1ccc(-c2ccccc2N)o1
InChIInChI=1S/C15H18N2O3/c1-19-10-4-9-17-15(18)14-8-7-13(20-14)11-5-2-3-6-12(11)16/h2-3,5-8H,4,9-10,16H2,1H3,(H,17,18)
InChIKeyKSTQMHKUZWWQKA-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.30
Rot. Bonds6

About 5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide

5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide (PubChem CID 91687714) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide
PubChem CID91687714
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide
SMILESCOCCCNC(=O)c1ccc(-c2ccccc2N)o1
InChIInChI=1S/C15H18N2O3/c1-19-10-4-9-17-15(18)14-8-7-13(20-14)11-5-2-3-6-12(11)16/h2-3,5-8H,4,9-10,16H2,1H3,(H,17,18)
InChIKeyKSTQMHKUZWWQKA-UHFFFAOYSA-N
XLogP2.30
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-(4-amino-2-chlorophenyl)-N-(3-methoxypropyl)furan-2-carboxamide
CID 91687739
N-(4-amino-4-oxobutyl)-5-(2-chlorophenyl)furan-2-carboxamide
CID 56812733
N-[3-(cyclopropylmethoxy)propyl]-5-(2-fluorophenyl)furan-2-carboxamide
CID 51222770
5-(4-amino-2-methylphenyl)-N-(2-methoxyethyl)furan-2-carboxamide
CID 91687732
methyl 6-[[5-(2-chlorophenyl)furan-2-carbonyl]amino]hexanoate
CID 134014900
N-(3-methoxypropyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
CID 110383767
N-(3-methoxypropyl)-5-[3-(trifluoromethyl)phenyl]furan-2-carboxamide
CID 9120331
3-amino-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 104740997
5-(2-chlorophenyl)-N-propylfuran-2-carboxamide
CID 5262410
2-amino-N-(3-methoxypropyl)-6-methylbenzamide
CID 43153249
2-(2-aminophenoxy)-N-(3-methoxypropyl)propanamide
CID 60747305
(2S)-2-[[5-(2-aminophenyl)furan-2-carbonyl]amino]-5-(diaminomethylamino)pentanoic acid
CID 69098326

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide?
The IUPAC name of 5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide (CID 91687714) is 5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide.
What is the SMILES notation for 5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide?
The canonical SMILES for 5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide is COCCCNC(=O)c1ccc(-c2ccccc2N)o1.
What is the InChIKey of 5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide?
The InChIKey is KSTQMHKUZWWQKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-19-10-4-9-17-15(18)14-8-7-13(20-14)11-5-2-3-6-12(11)16/h2-3,5-8H,4,9-10,16H2,1H3,(H,17,18).
What are the key properties of 5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide?
5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 2.30, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminophenyl)-N-(3-methoxypropyl)furan-2-carboxamide is sourced from PubChem (CID 91687714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).