3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide

C11H23N3O3 — CID 106275897

IUPAC3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide
SMILESCOCCCNC(=O)CNCC(C)(C)C(N)=O
InChIInChI=1S/C11H23N3O3/c1-11(2,10(12)16)8-13-7-9(15)14-5-4-6-17-3/h13H,4-8H2,1-3H3,(H2,12,16)(H,14,15)
InChIKeyWAAQTRNZTBCMJZ-UHFFFAOYSA-N
MW245.32 g/mol
LogP-0.76
Rot. Bonds9

About 3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide

3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide (PubChem CID 106275897) has the molecular formula C11H23N3O3 and a molecular weight of 245.32 g/mol. Its IUPAC name is 3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide.

Molecular Properties

Compound Name3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide
PubChem CID106275897
Molecular FormulaC11H23N3O3
Molecular Weight245.32 g/mol
Exact Mass245.17
IUPAC Name3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide
SMILESCOCCCNC(=O)CNCC(C)(C)C(N)=O
InChIInChI=1S/C11H23N3O3/c1-11(2,10(12)16)8-13-7-9(15)14-5-4-6-17-3/h13H,4-8H2,1-3H3,(H2,12,16)(H,14,15)
InChIKeyWAAQTRNZTBCMJZ-UHFFFAOYSA-N
XLogP-0.76
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 5-0.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyethylamino)-N-(3-methoxypropyl)acetamide;hydrochloride
CID 119672351
3-(2-methoxyethylamino)-2,2-dimethylpropanamide
CID 106276159
2-(2-hydroxyethylamino)-N-(3-methoxypropyl)acetamide
CID 60647414
2-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]acetic acid
CID 43466021
N-[3-(2-methoxyethoxy)propyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78931967
methyl 2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]acetate
CID 106276443
N-(2-methoxyethyl)-2-[(2-methoxy-2-methylpropyl)amino]acetamide
CID 104760634
N-(3-methoxypropyl)-2-[(2-methylpropan-2-yl)oxyamino]acetamide
CID 82723889
2-[(2-hydroxy-4,4-dimethylpentyl)amino]-N-(3-methoxypropyl)acetamide
CID 107152050
2-(2-ethoxyethylamino)-N-(3-methoxypropyl)acetamide
CID 61486039
4-(3-methoxypropylamino)-2,2-dimethyl-4-oxobutanoic acid
CID 65298010
2-[3-(2-hydroxyethoxy)propylamino]-N-(3-methoxypropyl)acetamide
CID 106309953

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide?
The IUPAC name of 3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide (CID 106275897) is 3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide.
What is the SMILES notation for 3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide?
The canonical SMILES for 3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide is COCCCNC(=O)CNCC(C)(C)C(N)=O.
What is the InChIKey of 3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide?
The InChIKey is WAAQTRNZTBCMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3/c1-11(2,10(12)16)8-13-7-9(15)14-5-4-6-17-3/h13H,4-8H2,1-3H3,(H2,12,16)(H,14,15).
What are the key properties of 3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide?
3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide has a molecular weight of 245.32 g/mol, XLogP of -0.76, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]-2,2-dimethylpropanamide is sourced from PubChem (CID 106275897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).