2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide

C15H18N2O3 — CID 61426558

IUPAC2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
SMILESCOc1ccc(N)c(C(=O)N(C)Cc2ccoc2C)c1
InChIInChI=1S/C15H18N2O3/c1-10-11(6-7-20-10)9-17(2)15(18)13-8-12(19-3)4-5-14(13)16/h4-8H,9,16H2,1-3H3
InChIKeyWFEJTVBKHQRXAS-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.45
Rot. Bonds4

About 2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide

2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide (PubChem CID 61426558) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide.

Molecular Properties

Compound Name2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
PubChem CID61426558
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
SMILESCOc1ccc(N)c(C(=O)N(C)Cc2ccoc2C)c1
InChIInChI=1S/C15H18N2O3/c1-10-11(6-7-20-10)9-17(2)15(18)13-8-12(19-3)4-5-14(13)16/h4-8H,9,16H2,1-3H3
InChIKeyWFEJTVBKHQRXAS-UHFFFAOYSA-N
XLogP2.45
TPSA68.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(furan-2-ylmethyl)-5-methoxy-N-methylbenzamide
CID 54878485
5-amino-N,2,4-trimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 102705344
4-amino-3-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 104782708
5-amino-2,4-difluoro-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 61426909
2-amino-5-methoxy-N-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 54904342
2-bromo-4-fluoro-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 61380894
3-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 61426906
2-amino-N-(2-cyanoethyl)-5-methoxy-N-methylbenzamide
CID 54878508
3-amino-4,5-dichloro-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 61426755
5-chloro-2-hydroxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 47379891
2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide
CID 61110256
2-amino-5-methoxy-N-methyl-N-[3-(methylamino)-3-oxopropyl]benzamide
CID 106913718

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide?
The IUPAC name of 2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide (CID 61426558) is 2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide.
What is the SMILES notation for 2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide?
The canonical SMILES for 2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide is COc1ccc(N)c(C(=O)N(C)Cc2ccoc2C)c1.
What is the InChIKey of 2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide?
The InChIKey is WFEJTVBKHQRXAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-10-11(6-7-20-10)9-17(2)15(18)13-8-12(19-3)4-5-14(13)16/h4-8H,9,16H2,1-3H3.
What are the key properties of 2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide?
2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide has a molecular weight of 274.32 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide is sourced from PubChem (CID 61426558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).