N-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide

C10H21N3O2 — CID 155943543

IUPACN-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide
SMILESCNCCC(=O)N(C)CCC(=O)N(C)C
InChIInChI=1S/C10H21N3O2/c1-11-7-5-10(15)13(4)8-6-9(14)12(2)3/h11H,5-8H2,1-4H3
InChIKeyQRIHHEXLKSWEHT-UHFFFAOYSA-N
MW215.30 g/mol
LogP-0.47
Rot. Bonds6

About N-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide

N-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide (PubChem CID 155943543) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is N-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide
PubChem CID155943543
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC NameN-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide
SMILESCNCCC(=O)N(C)CCC(=O)N(C)C
InChIInChI=1S/C10H21N3O2/c1-11-7-5-10(15)13(4)8-6-9(14)12(2)3/h11H,5-8H2,1-4H3
InChIKeyQRIHHEXLKSWEHT-UHFFFAOYSA-N
XLogP-0.47
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide?
The IUPAC name of N-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide (CID 155943543) is N-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide.
What is the SMILES notation for N-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide?
The canonical SMILES for N-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide is CNCCC(=O)N(C)CCC(=O)N(C)C.
What is the InChIKey of N-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide?
The InChIKey is QRIHHEXLKSWEHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-11-7-5-10(15)13(4)8-6-9(14)12(2)3/h11H,5-8H2,1-4H3.
What are the key properties of N-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide?
N-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide has a molecular weight of 215.30 g/mol, XLogP of -0.47, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)-3-oxopropyl]-N-methyl-3-(methylamino)propanamide is sourced from PubChem (CID 155943543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).