N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide

C12H26N2O2 — CID 103275017

IUPACN-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide
SMILESCCCOCC(=O)N(CC)C(C)CN(C)C
InChIInChI=1S/C12H26N2O2/c1-6-8-16-10-12(15)14(7-2)11(3)9-13(4)5/h11H,6-10H2,1-5H3
InChIKeyCAUIHQSFNNNFDL-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.21
Rot. Bonds8

About N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide

N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide (PubChem CID 103275017) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide
PubChem CID103275017
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide
SMILESCCCOCC(=O)N(CC)C(C)CN(C)C
InChIInChI=1S/C12H26N2O2/c1-6-8-16-10-12(15)14(7-2)11(3)9-13(4)5/h11H,6-10H2,1-5H3
InChIKeyCAUIHQSFNNNFDL-UHFFFAOYSA-N
XLogP1.21
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-(2-methoxyethoxy)acetamide
CID 103275016
N-(2-aminopropyl)-N-methyl-2-propoxyacetamide
CID 107941599
5-bromo-N-[1-(dimethylamino)propan-2-yl]-N-ethylpentanamide
CID 107910746
3-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3-methylbutanamide
CID 103188745
N-(3-amino-2-methylpropyl)-N-ethyl-2-propoxyacetamide
CID 107937276
2-(4-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]-N-ethylacetamide
CID 103188840
2-chloro-N-[1-(dimethylamino)propan-2-yl]-N-ethylpropanamide
CID 103187986
2-[2-(aminomethyl)phenoxy]-N-[1-(dimethylamino)propan-2-yl]-N-ethylacetamide
CID 103187433
2-(3-aminophenoxy)-N-[1-(dimethylamino)propan-2-yl]-N-ethylacetamide
CID 103187365
2-[methyl-(2-propoxyacetyl)amino]butanoic acid
CID 107937887
2-(2-aminoethoxy)-N-ethyl-N-(2-methylpropyl)acetamide
CID 79473023
2-(2-aminoethoxy)-N-propan-2-yl-N-propylacetamide
CID 79479983

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide?
The IUPAC name of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide (CID 103275017) is N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide.
What is the SMILES notation for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide?
The canonical SMILES for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide is CCCOCC(=O)N(CC)C(C)CN(C)C.
What is the InChIKey of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide?
The InChIKey is CAUIHQSFNNNFDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-6-8-16-10-12(15)14(7-2)11(3)9-13(4)5/h11H,6-10H2,1-5H3.
What are the key properties of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide?
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide has a molecular weight of 230.35 g/mol, XLogP of 1.21, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-propoxyacetamide is sourced from PubChem (CID 103275017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).