3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide

C12H25N3O2 — CID 114153668

IUPAC3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide
SMILESCCN1CCCC(C(C)NCC(O)C(N)=O)C1
InChIInChI=1S/C12H25N3O2/c1-3-15-6-4-5-10(8-15)9(2)14-7-11(16)12(13)17/h9-11,14,16H,3-8H2,1-2H3,(H2,13,17)
InChIKeyCVGPRLBLIVBKGX-UHFFFAOYSA-N
MW243.35 g/mol
LogP-0.46
Rot. Bonds6

About 3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide

3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide (PubChem CID 114153668) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide.

Molecular Properties

Compound Name3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide
PubChem CID114153668
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide
SMILESCCN1CCCC(C(C)NCC(O)C(N)=O)C1
InChIInChI=1S/C12H25N3O2/c1-3-15-6-4-5-10(8-15)9(2)14-7-11(16)12(13)17/h9-11,14,16H,3-8H2,1-2H3,(H2,13,17)
InChIKeyCVGPRLBLIVBKGX-UHFFFAOYSA-N
XLogP-0.46
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(1-ethylpiperidin-3-yl)ethyl]-2-methylpropan-1-amine
CID 43307395
3-[1-(1-ethylpiperidin-3-yl)ethylamino]propanoic acid
CID 43308794
N-[1-(1-ethylpiperidin-3-yl)ethyl]-2-methoxypropan-1-amine
CID 102696931
1-[[1-(1-ethylpiperidin-3-yl)ethylamino]methyl]cyclopentan-1-ol
CID 65105376
tert-butyl N-[1-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-methylpropan-2-yl]carbamate
CID 107250066
[4-[1-(1-ethylpiperidin-3-yl)ethylamino]phenyl]urea
CID 43744846
N-[1-(1-ethylpiperidin-3-yl)ethyl]octan-1-amine
CID 115566809
N-[1-(1-ethylpiperidin-3-yl)ethyl]butan-2-amine
CID 43307389
N-(2-cyclohexylethyl)-1-(1-ethylpiperidin-3-yl)ethanamine
CID 54931824
2-(1-ethylpiperidin-3-yl)-2-fluoroacetic acid
CID 105443609
N-[1-(1-ethylpiperidin-3-yl)ethyl]-1-pyrrolidin-1-ylpropan-2-amine
CID 61472215
3-[1-(1-methylpiperidin-3-yl)ethylamino]propane-1,2-diol
CID 66176759

Frequently Asked Questions

What is the IUPAC name of 3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide?
The IUPAC name of 3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide (CID 114153668) is 3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide.
What is the SMILES notation for 3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide?
The canonical SMILES for 3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide is CCN1CCCC(C(C)NCC(O)C(N)=O)C1.
What is the InChIKey of 3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide?
The InChIKey is CVGPRLBLIVBKGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-3-15-6-4-5-10(8-15)9(2)14-7-11(16)12(13)17/h9-11,14,16H,3-8H2,1-2H3,(H2,13,17).
What are the key properties of 3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide?
3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide has a molecular weight of 243.35 g/mol, XLogP of -0.46, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(1-ethylpiperidin-3-yl)ethylamino]-2-hydroxypropanamide is sourced from PubChem (CID 114153668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).