3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide

C16H24N2O2 — CID 119461064

IUPAC3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide
SMILESO=C(CCOCc1ccccc1)NCC1CCCNC1
InChIInChI=1S/C16H24N2O2/c19-16(18-12-15-7-4-9-17-11-15)8-10-20-13-14-5-2-1-3-6-14/h1-3,5-6,15,17H,4,7-13H2,(H,18,19)
InChIKeyLZQXZCXNBDAZKH-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.71
Rot. Bonds7

About 3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide

3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide (PubChem CID 119461064) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide
PubChem CID119461064
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide
SMILESO=C(CCOCc1ccccc1)NCC1CCCNC1
InChIInChI=1S/C16H24N2O2/c19-16(18-12-15-7-4-9-17-11-15)8-10-20-13-14-5-2-1-3-6-14/h1-3,5-6,15,17H,4,7-13H2,(H,18,19)
InChIKeyLZQXZCXNBDAZKH-UHFFFAOYSA-N
XLogP1.71
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride
CID 166436266
(3S)-3-(2-phenylmethoxyethyl)piperidine
CID 26192382
2-phenoxy-N-(piperidin-3-ylmethyl)acetamide
CID 60725547
N-(2-phenylmethoxyethyl)-2-[(3R)-pyrrolidin-3-yl]acetamide
CID 99624808
3-phenoxy-N-(pyrrolidin-3-ylmethyl)propanamide
CID 80564423
2-(4-benzylpiperazin-1-yl)-N-(piperidin-3-ylmethyl)acetamide
CID 119460598
4-(2-phenylethoxy)-N-(2-piperidin-3-ylethyl)butanamide
CID 119556464
2-(4-benzylpiperazin-1-yl)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride
CID 119460597
1-(2-phenylethyl)-3-[[(3S)-piperidin-3-yl]methyl]urea;hydrochloride
CID 165429715
N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461032
N-(3-methylpiperidin-4-yl)-3-phenylmethoxypropanamide
CID 120554516
3-(3-bromophenyl)-N-(piperidin-3-ylmethyl)propanamide;hydrochloride
CID 119462406

Frequently Asked Questions

What is the IUPAC name of 3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide?
The IUPAC name of 3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide (CID 119461064) is 3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide.
What is the SMILES notation for 3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide?
The canonical SMILES for 3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide is O=C(CCOCc1ccccc1)NCC1CCCNC1.
What is the InChIKey of 3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide?
The InChIKey is LZQXZCXNBDAZKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c19-16(18-12-15-7-4-9-17-11-15)8-10-20-13-14-5-2-1-3-6-14/h1-3,5-6,15,17H,4,7-13H2,(H,18,19).
What are the key properties of 3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide?
3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide has a molecular weight of 276.38 g/mol, XLogP of 1.71, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenylmethoxy-N-(piperidin-3-ylmethyl)propanamide is sourced from PubChem (CID 119461064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).