2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide

C14H19NO3 — CID 103738116

IUPAC2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide
SMILESCOc1cccc(C(=O)NCC2(C)CCC2)c1O
InChIInChI=1S/C14H19NO3/c1-14(7-4-8-14)9-15-13(17)10-5-3-6-11(18-2)12(10)16/h3,5-6,16H,4,7-9H2,1-2H3,(H,15,17)
InChIKeyPBTFSJZTNJPENL-UHFFFAOYSA-N
MW249.31 g/mol
LogP2.32
Rot. Bonds4

About 2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide

2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide (PubChem CID 103738116) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is 2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide
PubChem CID103738116
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC Name2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide
SMILESCOc1cccc(C(=O)NCC2(C)CCC2)c1O
InChIInChI=1S/C14H19NO3/c1-14(7-4-8-14)9-15-13(17)10-5-3-6-11(18-2)12(10)16/h3,5-6,16H,4,7-9H2,1-2H3,(H,15,17)
InChIKeyPBTFSJZTNJPENL-UHFFFAOYSA-N
XLogP2.32
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-N-[(1-hydroxycyclobutyl)methyl]-3-methoxybenzamide
CID 113248973
3-hydroxy-4-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide
CID 103738245
5-amino-2-methoxy-N-[(1-methylcyclopentyl)methyl]benzamide
CID 55262165
N-[2-(ethylamino)ethyl]-2-hydroxy-3-methoxybenzamide
CID 62656877
2-amino-N-[(1-methylcyclobutyl)methyl]benzamide;hydrochloride
CID 119945728
3-hydroxy-2-methyl-N-[(1-methylcyclopropyl)methyl]benzamide
CID 103873632
N-(2,2-dimethylpropyl)-2-hydroxy-3-methoxybenzamide
CID 61166501
2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 60682639
2-hydroxy-3-methoxy-N-(4-methylpiperidin-4-yl)benzamide
CID 114696306
2-hydroxy-N-(2-hydroxy-2-methylpropyl)-3-methoxybenzamide
CID 65109444
2-hydroxy-N-[2-(methanesulfonamido)ethyl]-3-methoxybenzamide
CID 43420679
2,3-dihydroxy-N-[(3-methylpiperidin-3-yl)methyl]benzamide
CID 114345124

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide?
The IUPAC name of 2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide (CID 103738116) is 2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide.
What is the SMILES notation for 2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide?
The canonical SMILES for 2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide is COc1cccc(C(=O)NCC2(C)CCC2)c1O.
What is the InChIKey of 2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide?
The InChIKey is PBTFSJZTNJPENL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3/c1-14(7-4-8-14)9-15-13(17)10-5-3-6-11(18-2)12(10)16/h3,5-6,16H,4,7-9H2,1-2H3,(H,15,17).
What are the key properties of 2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide?
2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide has a molecular weight of 249.31 g/mol, XLogP of 2.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide is sourced from PubChem (CID 103738116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).