3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide

C14H21N3O2 — CID 30604269

IUPAC3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
SMILESCC(C)NC(=O)CNC(=O)c1cccc(N(C)C)c1
InChIInChI=1S/C14H21N3O2/c1-10(2)16-13(18)9-15-14(19)11-6-5-7-12(8-11)17(3)4/h5-8,10H,9H2,1-4H3,(H,15,19)(H,16,18)
InChIKeyVHAKLVSOJPMMSE-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.01
Rot. Bonds5

About 3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide

3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide (PubChem CID 30604269) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
PubChem CID30604269
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
SMILESCC(C)NC(=O)CNC(=O)c1cccc(N(C)C)c1
InChIInChI=1S/C14H21N3O2/c1-10(2)16-13(18)9-15-14(19)11-6-5-7-12(8-11)17(3)4/h5-8,10H,9H2,1-4H3,(H,15,19)(H,16,18)
InChIKeyVHAKLVSOJPMMSE-UHFFFAOYSA-N
XLogP1.01
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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3-(dimethylamino)-N-(3,3-diphenylpropyl)benzamide
CID 7892053
3-(dimethylamino)-N-[2-(dimethylamino)-2-phenylethyl]benzamide
CID 42891486
N-(2,2-diethoxyethyl)-3-(dimethylamino)benzamide
CID 78909705
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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide?
The IUPAC name of 3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide (CID 30604269) is 3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide?
The canonical SMILES for 3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide is CC(C)NC(=O)CNC(=O)c1cccc(N(C)C)c1.
What is the InChIKey of 3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide?
The InChIKey is VHAKLVSOJPMMSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-10(2)16-13(18)9-15-14(19)11-6-5-7-12(8-11)17(3)4/h5-8,10H,9H2,1-4H3,(H,15,19)(H,16,18).
What are the key properties of 3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide?
3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide has a molecular weight of 263.34 g/mol, XLogP of 1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide is sourced from PubChem (CID 30604269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).