3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide

C13H20N2O2 — CID 43390448

IUPAC3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
SMILESCN(C)c1cccc(C(=O)NC(C)(C)CO)c1
InChIInChI=1S/C13H20N2O2/c1-13(2,9-16)14-12(17)10-6-5-7-11(8-10)15(3)4/h5-8,16H,9H2,1-4H3,(H,14,17)
InChIKeyIQDMVRYJSZISNP-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.25
Rot. Bonds4

About 3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide

3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide (PubChem CID 43390448) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
PubChem CID43390448
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
SMILESCN(C)c1cccc(C(=O)NC(C)(C)CO)c1
InChIInChI=1S/C13H20N2O2/c1-13(2,9-16)14-12(17)10-6-5-7-11(8-10)15(3)4/h5-8,16H,9H2,1-4H3,(H,14,17)
InChIKeyIQDMVRYJSZISNP-UHFFFAOYSA-N
XLogP1.25
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
CID 43498520
N-(1-hydroxy-2-methylpropan-2-yl)-3-(2-hydroxypropan-2-yl)benzamide
CID 110486078
N'-(4-tert-butylbenzoyl)-3-(dimethylamino)benzohydrazide
CID 26184746
N-(1-chloro-4,4-dimethylpentan-3-yl)-3-(dimethylamino)benzamide
CID 106355828
N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide
CID 639967
3-(2-amino-2-sulfanylideneethyl)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
CID 82178970
bis[3-(dimethylamino)phenyl]methanone
CID 14534104
3-(dimethylamino)-N-[[4-(hydroxymethyl)phenyl]methyl]benzamide
CID 107231911
3-(dimethylamino)-N'-(3-methylbutanoyl)benzohydrazide
CID 30485788
N-[(2R)-butan-2-yl]-3-(dimethylamino)benzamide
CID 25345776
N-butan-2-yl-3-(dimethylamino)benzamide
CID 17310829
N-(2-chloropropyl)-3-(dimethylamino)benzamide
CID 114296505

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide?
The IUPAC name of 3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide (CID 43390448) is 3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide?
The canonical SMILES for 3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide is CN(C)c1cccc(C(=O)NC(C)(C)CO)c1.
What is the InChIKey of 3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide?
The InChIKey is IQDMVRYJSZISNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-13(2,9-16)14-12(17)10-6-5-7-11(8-10)15(3)4/h5-8,16H,9H2,1-4H3,(H,14,17).
What are the key properties of 3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide?
3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide has a molecular weight of 236.31 g/mol, XLogP of 1.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide is sourced from PubChem (CID 43390448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).