2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide

C15H17NO3 — CID 61380836

IUPAC2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide
SMILESCc1cccc(C(=O)N(C)Cc2ccoc2C)c1O
InChIInChI=1S/C15H17NO3/c1-10-5-4-6-13(14(10)17)15(18)16(3)9-12-7-8-19-11(12)2/h4-8,17H,9H2,1-3H3
InChIKeyNYLOLZGRKQJKLJ-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.87
Rot. Bonds3

About 2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide

2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide (PubChem CID 61380836) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide
PubChem CID61380836
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC Name2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide
SMILESCc1cccc(C(=O)N(C)Cc2ccoc2C)c1O
InChIInChI=1S/C15H17NO3/c1-10-5-4-6-13(14(10)17)15(18)16(3)9-12-7-8-19-11(12)2/h4-8,17H,9H2,1-3H3
InChIKeyNYLOLZGRKQJKLJ-UHFFFAOYSA-N
XLogP2.87
TPSA53.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-N,2,4-trimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 102705344
2-(dimethylamino)-N-methyl-N-[(2-methylfuran-3-yl)methyl]pyridine-3-carboxamide
CID 56819277
N-methyl-2-[2-(methylamino)ethyl]-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 104547733
5-chloro-2-hydroxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 47379891
6-chloro-N-methyl-N-[(2-methylfuran-3-yl)methyl]pyridine-2-carboxamide
CID 55052208
3-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 61426906
3-(aminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 61426369
2-bromo-4-fluoro-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 61380894
5-amino-2,4-difluoro-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 61426909
2-amino-5-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 61426558
4-chloro-N,6-dimethyl-N-[(2-methylfuran-3-yl)methyl]pyridine-3-carboxamide
CID 81226370
N-(2-bromopropyl)-2-hydroxy-N,3-dimethylbenzamide
CID 80666341

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide?
The IUPAC name of 2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide (CID 61380836) is 2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide.
What is the SMILES notation for 2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide?
The canonical SMILES for 2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide is Cc1cccc(C(=O)N(C)Cc2ccoc2C)c1O.
What is the InChIKey of 2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide?
The InChIKey is NYLOLZGRKQJKLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-10-5-4-6-13(14(10)17)15(18)16(3)9-12-7-8-19-11(12)2/h4-8,17H,9H2,1-3H3.
What are the key properties of 2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide?
2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide has a molecular weight of 259.31 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide is sourced from PubChem (CID 61380836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).