N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride

C12H26ClN3O3 — CID 119756312

IUPACN-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride
SMILESCCC(C)NC(=O)C(C)NC(=O)CNCCOC.Cl
InChIInChI=1S/C12H25N3O3.ClH/c1-5-9(2)14-12(17)10(3)15-11(16)8-13-6-7-18-4;/h9-10,13H,5-8H2,1-4H3,(H,14,17)(H,15,16);1H
InChIKeyNELHOBXJUZGBOM-UHFFFAOYSA-N
MW295.81 g/mol
LogP0.06
Rot. Bonds9

About N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride

N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride (PubChem CID 119756312) has the molecular formula C12H26ClN3O3 and a molecular weight of 295.81 g/mol. Its IUPAC name is N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride.

Molecular Properties

Compound NameN-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride
PubChem CID119756312
Molecular FormulaC12H26ClN3O3
Molecular Weight295.81 g/mol
Exact Mass295.17
IUPAC NameN-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride
SMILESCCC(C)NC(=O)C(C)NC(=O)CNCCOC.Cl
InChIInChI=1S/C12H25N3O3.ClH/c1-5-9(2)14-12(17)10(3)15-11(16)8-13-6-7-18-4;/h9-10,13H,5-8H2,1-4H3,(H,14,17)(H,15,16);1H
InChIKeyNELHOBXJUZGBOM-UHFFFAOYSA-N
XLogP0.06
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.81
LogP ≤ 50.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]propanoate
CID 79282260
2-[[2-(butan-2-ylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)propanamide
CID 113407011
N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide
CID 119756291
2-[[2-(2-methoxyethylamino)acetyl]amino]-N-phenylpropanamide;hydrochloride
CID 119785054
N-(5,5-dimethylhexan-2-yl)-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119796579
N-(1-cyclopropylpropan-2-yl)-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119784608
N-butan-2-yl-2-[(4-methoxy-2,2-dimethylbutyl)amino]propanamide
CID 104624297
N-(1-ethoxy-3-methylbutan-2-yl)-2-(2-methoxyethylamino)acetamide
CID 114113781
N-[1-(4-ethylsulfanylphenyl)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119774161
2-(4-methoxybutylamino)-N-pentan-2-ylacetamide
CID 60976896
N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-2-(2-methoxyethylamino)acetamide
CID 119863555
2-(2-methoxyethylamino)-N-[1-(4-methoxyphenyl)propyl]acetamide;hydrochloride
CID 119689364

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride?
The IUPAC name of N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride (CID 119756312) is N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride.
What is the SMILES notation for N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride?
The canonical SMILES for N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride is CCC(C)NC(=O)C(C)NC(=O)CNCCOC.Cl.
What is the InChIKey of N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride?
The InChIKey is NELHOBXJUZGBOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O3.ClH/c1-5-9(2)14-12(17)10(3)15-11(16)8-13-6-7-18-4;/h9-10,13H,5-8H2,1-4H3,(H,14,17)(H,15,16);1H.
What are the key properties of N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride?
N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride has a molecular weight of 295.81 g/mol, XLogP of 0.06, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride is sourced from PubChem (CID 119756312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).