N-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide

C13H28N2O4 — CID 106990635

IUPACN-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)NCC(O)COC(C)COC
InChIInChI=1S/C13H28N2O4/c1-6-15(4)13(17)11(3)14-7-12(16)9-19-10(2)8-18-5/h10-12,14,16H,6-9H2,1-5H3
InChIKeyGCKSTIWQOHOMKA-UHFFFAOYSA-N
MW276.38 g/mol
LogP-0.14
Rot. Bonds10

About N-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide

N-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide (PubChem CID 106990635) has the molecular formula C13H28N2O4 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide.

Molecular Properties

Compound NameN-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide
PubChem CID106990635
Molecular FormulaC13H28N2O4
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)NCC(O)COC(C)COC
InChIInChI=1S/C13H28N2O4/c1-6-15(4)13(17)11(3)14-7-12(16)9-19-10(2)8-18-5/h10-12,14,16H,6-9H2,1-5H3
InChIKeyGCKSTIWQOHOMKA-UHFFFAOYSA-N
XLogP-0.14
TPSA71.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3-butoxy-2-hydroxypropyl)amino]-N-ethyl-N-methylpropanamide
CID 107263156
2-[(3-cyclopentyloxy-2-hydroxypropyl)amino]-N-ethyl-N-methylpropanamide
CID 103108529
1-[ethyl(methyl)amino]-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106991712
2-[[3-(3-chlorophenoxy)-2-hydroxypropyl]amino]-N-ethyl-N-methylpropanamide
CID 103108426
2-(cyanomethylamino)-N-ethyl-N-methylpropanamide
CID 103108493
1-(2-methoxyethoxyamino)-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106990341
1-methoxy-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 107508429
N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]-N-methylpropanamide
CID 103108710
1-[1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]butan-2-ol
CID 20834285
2-(2-hydroxybutylamino)-N,N-dimethylpropanamide
CID 61464462
1-(1-methoxypropan-2-yloxy)-3-(2-methylpropoxyamino)propan-2-ol
CID 106990337
2-(cyclopropylmethylamino)-N-ethyl-N-methylpropanamide
CID 103106979

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide?
The IUPAC name of N-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide (CID 106990635) is N-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide.
What is the SMILES notation for N-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide?
The canonical SMILES for N-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide is CCN(C)C(=O)C(C)NCC(O)COC(C)COC.
What is the InChIKey of N-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide?
The InChIKey is GCKSTIWQOHOMKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O4/c1-6-15(4)13(17)11(3)14-7-12(16)9-19-10(2)8-18-5/h10-12,14,16H,6-9H2,1-5H3.
What are the key properties of N-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide?
N-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide has a molecular weight of 276.38 g/mol, XLogP of -0.14, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-N-methylpropanamide is sourced from PubChem (CID 106990635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).