2-(1-methoxypropan-2-ylamino)-N-propylacetamide

C9H20N2O2 — CID 43179596

IUPAC2-(1-methoxypropan-2-ylamino)-N-propylacetamide
SMILESCCCNC(=O)CNC(C)COC
InChIInChI=1S/C9H20N2O2/c1-4-5-10-9(12)6-11-8(2)7-13-3/h8,11H,4-7H2,1-3H3,(H,10,12)
InChIKeyXRQOWGDTUHHAQX-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.14
Rot. Bonds7

About 2-(1-methoxypropan-2-ylamino)-N-propylacetamide

2-(1-methoxypropan-2-ylamino)-N-propylacetamide (PubChem CID 43179596) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-(1-methoxypropan-2-ylamino)-N-propylacetamide.

Molecular Properties

Compound Name2-(1-methoxypropan-2-ylamino)-N-propylacetamide
PubChem CID43179596
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name2-(1-methoxypropan-2-ylamino)-N-propylacetamide
SMILESCCCNC(=O)CNC(C)COC
InChIInChI=1S/C9H20N2O2/c1-4-5-10-9(12)6-11-8(2)7-13-3/h8,11H,4-7H2,1-3H3,(H,10,12)
InChIKeyXRQOWGDTUHHAQX-UHFFFAOYSA-N
XLogP0.14
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butyl-2-(1-methoxypropan-2-ylamino)acetamide
CID 60672222
2-(1-methoxypropan-2-ylamino)-N-pentan-3-ylacetamide
CID 60672224
2-(1-cyanopropan-2-ylamino)-N-propylacetamide
CID 60913977
2-(3-methylbutan-2-ylamino)-N-propylacetamide
CID 43086366
2-[[(2S)-butan-2-yl]amino]-N-[2-[[2-[[(2R)-butan-2-yl]amino]acetyl]amino]ethyl]acetamide
CID 26058062
N-butyl-2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]propanamide
CID 112683886
2-(butan-2-ylamino)-N-[3-(2-methoxyethoxy)propyl]acetamide
CID 61274259
N-propyl-2-(1-pyrrolidin-1-ylpropan-2-ylamino)acetamide
CID 61473889
2-[1-(2-methoxyphenyl)propan-2-ylamino]-N-propylacetamide
CID 43777802
2-[[ethylamino-(1-methoxypropan-2-ylamino)methylidene]amino]-N-propylacetamide;hydroiodide
CID 111237098
2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]-N-propylacetamide
CID 79250505
N-(3-methylbutyl)-2-(pentan-2-ylamino)acetamide
CID 60672196

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxypropan-2-ylamino)-N-propylacetamide?
The IUPAC name of 2-(1-methoxypropan-2-ylamino)-N-propylacetamide (CID 43179596) is 2-(1-methoxypropan-2-ylamino)-N-propylacetamide.
What is the SMILES notation for 2-(1-methoxypropan-2-ylamino)-N-propylacetamide?
The canonical SMILES for 2-(1-methoxypropan-2-ylamino)-N-propylacetamide is CCCNC(=O)CNC(C)COC.
What is the InChIKey of 2-(1-methoxypropan-2-ylamino)-N-propylacetamide?
The InChIKey is XRQOWGDTUHHAQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-4-5-10-9(12)6-11-8(2)7-13-3/h8,11H,4-7H2,1-3H3,(H,10,12).
What are the key properties of 2-(1-methoxypropan-2-ylamino)-N-propylacetamide?
2-(1-methoxypropan-2-ylamino)-N-propylacetamide has a molecular weight of 188.27 g/mol, XLogP of 0.14, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxypropan-2-ylamino)-N-propylacetamide is sourced from PubChem (CID 43179596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).