N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide

C13H26N2O3 — CID 106247359

IUPACN-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide
SMILESCOCC(O)CCNC(=O)CCC1CCNCC1
InChIInChI=1S/C13H26N2O3/c1-18-10-12(16)6-9-15-13(17)3-2-11-4-7-14-8-5-11/h11-12,14,16H,2-10H2,1H3,(H,15,17)
InChIKeyJYIBNZNADMKTAW-UHFFFAOYSA-N
MW258.36 g/mol
LogP0.28
Rot. Bonds8

About N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide

N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide (PubChem CID 106247359) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide
PubChem CID106247359
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC NameN-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide
SMILESCOCC(O)CCNC(=O)CCC1CCNCC1
InChIInChI=1S/C13H26N2O3/c1-18-10-12(16)6-9-15-13(17)3-2-11-4-7-14-8-5-11/h11-12,14,16H,2-10H2,1H3,(H,15,17)
InChIKeyJYIBNZNADMKTAW-UHFFFAOYSA-N
XLogP0.28
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 50.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-hydroxy-4-(3-piperidin-4-ylpropanoylamino)butanoic acid
CID 114006841
2-methyl-4-(3-piperidin-4-ylpropanoylamino)butanoic acid
CID 80539959
4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide
CID 106248553
2-cyclobutyl-N-(3-hydroxy-4-methoxybutyl)acetamide
CID 103877418
N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide
CID 115870643
N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide
CID 113343484
N-(3-hydroxy-4-methoxybutyl)pentanamide
CID 103877026
N-(3-hydroxy-4-methoxybutyl)-2-pyrrolidin-2-ylacetamide
CID 106247356
N-(2-methoxy-2-methylpropyl)-3-piperidin-4-ylpropanamide
CID 113343490
N-[2-(dimethylcarbamoylamino)ethyl]-3-piperidin-4-ylpropanamide
CID 83109441
N-(3-aminopropyl)-3-piperidin-4-ylpropanamide
CID 62211796
N-(4-hydroxybutyl)-3-piperidin-4-ylpropanamide
CID 106841935

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide?
The IUPAC name of N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide (CID 106247359) is N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide.
What is the SMILES notation for N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide?
The canonical SMILES for N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide is COCC(O)CCNC(=O)CCC1CCNCC1.
What is the InChIKey of N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide?
The InChIKey is JYIBNZNADMKTAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-18-10-12(16)6-9-15-13(17)3-2-11-4-7-14-8-5-11/h11-12,14,16H,2-10H2,1H3,(H,15,17).
What are the key properties of N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide?
N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide has a molecular weight of 258.36 g/mol, XLogP of 0.28, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide is sourced from PubChem (CID 106247359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).