N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide

C14H26N2O2 — CID 113343484

IUPACN-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide
SMILESO=C(CCC1CCNCC1)NCCOCC1CC1
InChIInChI=1S/C14H26N2O2/c17-14(4-3-12-5-7-15-8-6-12)16-9-10-18-11-13-1-2-13/h12-13,15H,1-11H2,(H,16,17)
InChIKeyLUBIKYAURLXHKL-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.31
Rot. Bonds8

About N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide

N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide (PubChem CID 113343484) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide
PubChem CID113343484
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide
SMILESO=C(CCC1CCNCC1)NCCOCC1CC1
InChIInChI=1S/C14H26N2O2/c17-14(4-3-12-5-7-15-8-6-12)16-9-10-18-11-13-1-2-13/h12-13,15H,1-11H2,(H,16,17)
InChIKeyLUBIKYAURLXHKL-UHFFFAOYSA-N
XLogP1.31
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide
CID 115870643
N-[3-(cyclopropylmethoxy)propyl]-3-piperidin-4-yloxypropanamide
CID 63876469
N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide
CID 62211306
N-(3-aminopropyl)-3-piperidin-4-ylpropanamide
CID 62211796
N-(4-hydroxybutyl)-3-piperidin-4-ylpropanamide
CID 106841935
N-(2-piperidin-4-ylethyl)-3-propoxypropanamide
CID 62714933
N-(3-cyclohexyloxypropyl)-3-piperidin-4-ylpropanamide
CID 62210078
N-(3-hydroxy-4-methoxybutyl)-3-piperidin-4-ylpropanamide
CID 106247359
N-[2-(dimethylcarbamoylamino)ethyl]-3-piperidin-4-ylpropanamide
CID 83109441
3-(4-aminocyclohexyl)-N-(2-ethoxyethyl)propanamide
CID 62777706
3-cyclopentyl-N-[2-(2-hydroxyethoxy)ethyl]propanamide
CID 60654438
2-hydroxy-4-(3-piperidin-4-ylpropanoylamino)butanoic acid
CID 114006841

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide?
The IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide (CID 113343484) is N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide.
What is the SMILES notation for N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide?
The canonical SMILES for N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide is O=C(CCC1CCNCC1)NCCOCC1CC1.
What is the InChIKey of N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide?
The InChIKey is LUBIKYAURLXHKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c17-14(4-3-12-5-7-15-8-6-12)16-9-10-18-11-13-1-2-13/h12-13,15H,1-11H2,(H,16,17).
What are the key properties of N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide?
N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide has a molecular weight of 254.37 g/mol, XLogP of 1.31, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide is sourced from PubChem (CID 113343484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).