N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide

C11H24N2O2 — CID 107937276

IUPACN-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide
SMILESCCCOCC(=O)N(CC)CC(C)CN
InChIInChI=1S/C11H24N2O2/c1-4-6-15-9-11(14)13(5-2)8-10(3)7-12/h10H,4-9,12H2,1-3H3
InChIKeyUVHQPDLSTHYIFC-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.86
Rot. Bonds8

About N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide

N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide (PubChem CID 107937276) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide
PubChem CID107937276
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide
SMILESCCCOCC(=O)N(CC)CC(C)CN
InChIInChI=1S/C11H24N2O2/c1-4-6-15-9-11(14)13(5-2)8-10(3)7-12/h10H,4-9,12H2,1-3H3
InChIKeyUVHQPDLSTHYIFC-UHFFFAOYSA-N
XLogP0.86
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-aminoethoxy)-N-ethyl-N-(2-methylpropyl)acetamide
CID 79473023
2-[2-[ethyl(2-methylbutyl)amino]-2-oxoethoxy]acetic acid
CID 79477429
N-(2-aminopropyl)-N-methyl-2-propoxyacetamide
CID 107941599
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide
CID 103275017
N,N-dibutyl-2-propoxyacetamide
CID 48656867
2-[2-(diethylamino)-2-oxoethoxy]-N,N-diethylacetamide
CID 12729092
N-(3-amino-2-methylpropyl)-N-ethyl-3-propoxybenzamide
CID 62919665
5-amino-N-ethyl-N-(2-ethylbutyl)-4-methylpentanamide
CID 82011557
3-(aminomethyl)-N-ethyl-5-methyl-N-(2-methylbutyl)hexanamide
CID 79469974
4-amino-N,N-bis(2-ethoxyethyl)-3-methylbutanamide
CID 82964992
N-(2-aminoethyl)-N-ethyl-3-propoxypropanamide
CID 62688574
5-amino-N-ethyl-N-(2-methylbutyl)pentanamide
CID 79470392

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide?
The IUPAC name of N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide (CID 107937276) is N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide?
The canonical SMILES for N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide is CCCOCC(=O)N(CC)CC(C)CN.
What is the InChIKey of N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide?
The InChIKey is UVHQPDLSTHYIFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-4-6-15-9-11(14)13(5-2)8-10(3)7-12/h10H,4-9,12H2,1-3H3.
What are the key properties of N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide?
N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide has a molecular weight of 216.32 g/mol, XLogP of 0.86, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide is sourced from PubChem (CID 107937276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).