N-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide

C18H41N3O2 — CID 54534060

IUPACN-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide
SMILESCCC(=O)N(C)CC.CCCN(C)C(C)=O.CCCN(C)CC
InChIInChI=1S/2C6H13NO.C6H15N/c1-4-5-7(3)6(2)8;1-4-6(8)7(3)5-2;1-4-6-7(3)5-2/h2*4-5H2,1-3H3;4-6H2,1-3H3
InChIKeyYYNSLPNQAKHTEN-UHFFFAOYSA-N
MW331.55 g/mol
LogP3.10
Rot. Bonds7

About N-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide

N-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide (PubChem CID 54534060) has the molecular formula C18H41N3O2 and a molecular weight of 331.55 g/mol. Its IUPAC name is N-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide.

Molecular Properties

Compound NameN-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide
PubChem CID54534060
Molecular FormulaC18H41N3O2
Molecular Weight331.55 g/mol
Exact Mass331.32
IUPAC NameN-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide
SMILESCCC(=O)N(C)CC.CCCN(C)C(C)=O.CCCN(C)CC
InChIInChI=1S/2C6H13NO.C6H15N/c1-4-5-7(3)6(2)8;1-4-6(8)7(3)5-2;1-4-6-7(3)5-2/h2*4-5H2,1-3H3;4-6H2,1-3H3
InChIKeyYYNSLPNQAKHTEN-UHFFFAOYSA-N
XLogP3.10
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.55
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-Dibutylpropanamide
CID 70909
N,N-Dipropylacetamide
CID 70690
Propanamide, N,N-dipropyl-
CID 70687
N,N,N',N'-Tetraethylmalonamide
CID 551770
N,N,N',N'-Tetrabutylmalonamide
CID 3494509
N,N,N',N'-Tetrapropylmalonamide
CID 2384358
N,N,N',N'-tetrabutylbutanediamide
CID 4572068
N-[3-[acetyl(methyl)amino]propyl]-N-methylacetamide
CID 22908371
N,N,N',N'-Tetrapentylmalonamide
CID 44630524
N,N,N',N'-Tetraisobutyl-malonamide
CID 1809489
Oxalic acid, diamide, N,N,N',N'-tetrabutyl-
CID 3417535
N-butyl-N-methylpropanamide
CID 20644861

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide?
The IUPAC name of N-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide (CID 54534060) is N-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide.
What is the SMILES notation for N-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide?
The canonical SMILES for N-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide is CCC(=O)N(C)CC.CCCN(C)C(C)=O.CCCN(C)CC.
What is the InChIKey of N-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide?
The InChIKey is YYNSLPNQAKHTEN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H13NO.C6H15N/c1-4-5-7(3)6(2)8;1-4-6(8)7(3)5-2;1-4-6-7(3)5-2/h2*4-5H2,1-3H3;4-6H2,1-3H3.
What are the key properties of N-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide?
N-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide has a molecular weight of 331.55 g/mol, XLogP of 3.10, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methylpropanamide;N-ethyl-N-methylpropan-1-amine;N-methyl-N-propylacetamide is sourced from PubChem (CID 54534060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).