2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide

C17H34N2O2 — CID 87022032

IUPAC2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN1CCC(OCC(C)C)CC1
InChIInChI=1S/C17H34N2O2/c1-5-9-19(10-6-2)17(20)13-18-11-7-16(8-12-18)21-14-15(3)4/h15-16H,5-14H2,1-4H3
InChIKeyARFHDTRIUDWKIP-UHFFFAOYSA-N
MW298.47 g/mol
LogP2.77
Rot. Bonds9

About 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide

2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide (PubChem CID 87022032) has the molecular formula C17H34N2O2 and a molecular weight of 298.47 g/mol. Its IUPAC name is 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide
PubChem CID87022032
Molecular FormulaC17H34N2O2
Molecular Weight298.47 g/mol
Exact Mass298.26
IUPAC Name2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN1CCC(OCC(C)C)CC1
InChIInChI=1S/C17H34N2O2/c1-5-9-19(10-6-2)17(20)13-18-11-7-16(8-12-18)21-14-15(3)4/h15-16H,5-14H2,1-4H3
InChIKeyARFHDTRIUDWKIP-UHFFFAOYSA-N
XLogP2.77
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-Methoxypiperidin-1-yl)-1-piperidin-1-ylethanone
CID 53524569
1-[2-[4-(2-Methylpropoxy)piperidin-1-yl]-2-oxoethyl]azepan-2-one
CID 71939198
2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide
CID 78898292
2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide
CID 78903326
N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 78903328
(2S)-2-(dimethylamino)-1-(4-ethoxypiperidin-1-yl)-3-methylbutan-1-one
CID 71855127
1-(4-Ethoxypiperidin-1-yl)-2-methylpropan-1-one
CID 61150672
1-(4-Ethoxypiperidin-1-yl)-2-(methylamino)ethan-1-one
CID 61216151
2-Amino-1-(4-ethoxypiperidin-1-yl)ethanone
CID 61217553
[1-[2-(Dimethylamino)acetyl]piperidin-4-yl] acetate
CID 67707547
2-Methyl-1-[4-(3-propan-2-yloxypropyl)piperazin-1-yl]propan-1-one
CID 68267207
2-(Dimethylamino)-1-(4-propan-2-yloxypiperidin-1-yl)ethanone
CID 68267285

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide?
The IUPAC name of 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide (CID 87022032) is 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide.
What is the SMILES notation for 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide?
The canonical SMILES for 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide is CCCN(CCC)C(=O)CN1CCC(OCC(C)C)CC1.
What is the InChIKey of 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide?
The InChIKey is ARFHDTRIUDWKIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O2/c1-5-9-19(10-6-2)17(20)13-18-11-7-16(8-12-18)21-14-15(3)4/h15-16H,5-14H2,1-4H3.
What are the key properties of 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide?
2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide has a molecular weight of 298.47 g/mol, XLogP of 2.77, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,N-dipropylacetamide is sourced from PubChem (CID 87022032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).