N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide

C15H22N2O2 — CID 63740558

IUPACN,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide
SMILESCNC(=O)c1cccc(NCC2CCCOC2)c1C
InChIInChI=1S/C15H22N2O2/c1-11-13(15(18)16-2)6-3-7-14(11)17-9-12-5-4-8-19-10-12/h3,6-7,12,17H,4-5,8-10H2,1-2H3,(H,16,18)
InChIKeyFOLHSMLQCCDOAW-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.19
Rot. Bonds4

About N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide

N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide (PubChem CID 63740558) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide.

Molecular Properties

Compound NameN,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide
PubChem CID63740558
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide
SMILESCNC(=O)c1cccc(NCC2CCCOC2)c1C
InChIInChI=1S/C15H22N2O2/c1-11-13(15(18)16-2)6-3-7-14(11)17-9-12-5-4-8-19-10-12/h3,6-7,12,17H,4-5,8-10H2,1-2H3,(H,16,18)
InChIKeyFOLHSMLQCCDOAW-UHFFFAOYSA-N
XLogP2.19
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-dimethyl-3-[(1-methylpiperidin-3-yl)methylamino]benzamide
CID 62658463
N-[2-methyl-3-(oxan-3-ylmethylamino)phenyl]propanamide
CID 63739677
methyl 2-methyl-3-(oxolan-3-ylmethylamino)benzoate
CID 43714476
2-methyl-3-(oxan-3-ylmethylamino)benzenesulfonamide
CID 55242224
2-hydroxy-3-methyl-N-(oxan-3-ylmethyl)benzamide
CID 61073826
2-chloro-N-methyl-5-(oxan-3-ylmethylamino)benzamide
CID 63740745
2-bromo-3-methyl-N-(oxan-3-ylmethyl)benzamide
CID 113338886
3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide
CID 115916570
1-[2-(oxan-3-ylmethylamino)phenyl]ethanol
CID 63739863
2-methyl-3-(oxolan-3-ylmethylamino)benzenesulfonamide
CID 54867006
N-(oxan-3-ylmethyl)-2-propylsulfonylaniline
CID 61020152
3-[(5-ethylfuran-2-yl)methylamino]-N,2-dimethylbenzamide
CID 62345277

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide?
The IUPAC name of N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide (CID 63740558) is N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide.
What is the SMILES notation for N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide?
The canonical SMILES for N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide is CNC(=O)c1cccc(NCC2CCCOC2)c1C.
What is the InChIKey of N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide?
The InChIKey is FOLHSMLQCCDOAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-13(15(18)16-2)6-3-7-14(11)17-9-12-5-4-8-19-10-12/h3,6-7,12,17H,4-5,8-10H2,1-2H3,(H,16,18).
What are the key properties of N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide?
N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide has a molecular weight of 262.35 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide is sourced from PubChem (CID 63740558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).