N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide

C17H26N2O2 — CID 62378766

IUPACN-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide
SMILESO=C(CCC1CCNCC1)NCCCOc1ccccc1
InChIInChI=1S/C17H26N2O2/c20-17(8-7-15-9-12-18-13-10-15)19-11-4-14-21-16-5-2-1-3-6-16/h1-3,5-6,15,18H,4,7-14H2,(H,19,20)
InChIKeyVMSNZLINMCRBEU-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.35
Rot. Bonds8

About N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide

N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide (PubChem CID 62378766) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide
PubChem CID62378766
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide
SMILESO=C(CCC1CCNCC1)NCCCOc1ccccc1
InChIInChI=1S/C17H26N2O2/c20-17(8-7-15-9-12-18-13-10-15)19-11-4-14-21-16-5-2-1-3-6-16/h1-3,5-6,15,18H,4,7-14H2,(H,19,20)
InChIKeyVMSNZLINMCRBEU-UHFFFAOYSA-N
XLogP2.35
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.35
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-phenoxyethyl)-3-piperidin-4-ylpropanamide
CID 62211306
N-[2-(3-methylphenoxy)ethyl]-3-piperidin-4-ylpropanamide
CID 62211308
N-(3-phenoxypropyl)-2-piperidin-4-ylsulfanylacetamide
CID 114627443
3-phenoxy-N-(pyrrolidin-3-ylmethyl)propanamide
CID 80564423
2-(cyclopropylmethylamino)-N-(3-phenoxypropyl)acetamide
CID 62380963
N-(3-cyclohexyloxypropyl)-3-piperidin-4-ylpropanamide
CID 62210078
N-(3-aminopropyl)-3-piperidin-4-ylpropanamide
CID 62211796
N-(4-hydroxybutyl)-3-piperidin-4-ylpropanamide
CID 106841935
2-(2-phenoxyethoxy)-N-(2-pyrrolidin-3-ylethyl)acetamide
CID 119533647
2-(azetidin-3-yl)-N-(2-phenoxyethyl)acetamide
CID 64609991
N-[2-(1-methylpiperidin-4-yl)ethyl]-4-phenoxybutanamide
CID 50875549
N-(2-phenoxyethyl)-3-piperidin-4-ylbutanamide
CID 119684535

Frequently Asked Questions

What is the IUPAC name of N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide?
The IUPAC name of N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide (CID 62378766) is N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide.
What is the SMILES notation for N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide?
The canonical SMILES for N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide is O=C(CCC1CCNCC1)NCCCOc1ccccc1.
What is the InChIKey of N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide?
The InChIKey is VMSNZLINMCRBEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c20-17(8-7-15-9-12-18-13-10-15)19-11-4-14-21-16-5-2-1-3-6-16/h1-3,5-6,15,18H,4,7-14H2,(H,19,20).
What are the key properties of N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide?
N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide has a molecular weight of 290.41 g/mol, XLogP of 2.35, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide is sourced from PubChem (CID 62378766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).