4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide

C14H31N3O2 — CID 81061737

IUPAC4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide
SMILESCCOCCN(C)C(C)CC(C)(NC(C)C)C(N)=O
InChIInChI=1S/C14H31N3O2/c1-7-19-9-8-17(6)12(4)10-14(5,13(15)18)16-11(2)3/h11-12,16H,7-10H2,1-6H3,(H2,15,18)
InChIKeySQGJYOWJOZCEHA-UHFFFAOYSA-N
MW273.42 g/mol
LogP0.98
Rot. Bonds10

About 4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide

4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide (PubChem CID 81061737) has the molecular formula C14H31N3O2 and a molecular weight of 273.42 g/mol. Its IUPAC name is 4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide.

Molecular Properties

Compound Name4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide
PubChem CID81061737
Molecular FormulaC14H31N3O2
Molecular Weight273.42 g/mol
Exact Mass273.24
IUPAC Name4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide
SMILESCCOCCN(C)C(C)CC(C)(NC(C)C)C(N)=O
InChIInChI=1S/C14H31N3O2/c1-7-19-9-8-17(6)12(4)10-14(5,13(15)18)16-11(2)3/h11-12,16H,7-10H2,1-6H3,(H2,15,18)
InChIKeySQGJYOWJOZCEHA-UHFFFAOYSA-N
XLogP0.98
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide 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 4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanoate
CID 81044614
2-amino-4-[2-ethoxyethyl(methyl)amino]-2-methylpentanamide
CID 81061651
4-(diethylamino)-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64726179
2-methyl-4-[methyl(2-propan-2-yloxyethyl)amino]-2-(propan-2-ylamino)pentanoic acid
CID 81074022
ethyl 2-methyl-4-[methyl(3-methylbutyl)amino]-2-(propan-2-ylamino)pentanoate
CID 64710729
4-[butan-2-yl(2-methoxyethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64710876
4-[2-methoxyethyl(methyl)amino]-2-methyl-2-(propylamino)pentanamide
CID 64710690
4-[2-(dimethylamino)ethyl-methylamino]-2-methyl-2-(methylamino)pentanamide
CID 64704415
4-ethoxy-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64707210
2-methyl-2-(methylamino)-4-[methyl(pentyl)amino]pentanamide
CID 64710154
4-[ethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanoic acid
CID 64727241
ethyl 2-methyl-4-[methyl(2,2,2-trifluoroethyl)amino]-2-(propan-2-ylamino)pentanoate
CID 64710599

Frequently Asked Questions

What is the IUPAC name of 4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide?
The IUPAC name of 4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide (CID 81061737) is 4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide.
What is the SMILES notation for 4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide?
The canonical SMILES for 4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide is CCOCCN(C)C(C)CC(C)(NC(C)C)C(N)=O.
What is the InChIKey of 4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide?
The InChIKey is SQGJYOWJOZCEHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N3O2/c1-7-19-9-8-17(6)12(4)10-14(5,13(15)18)16-11(2)3/h11-12,16H,7-10H2,1-6H3,(H2,15,18).
What are the key properties of 4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide?
4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide has a molecular weight of 273.42 g/mol, XLogP of 0.98, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanamide is sourced from PubChem (CID 81061737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).