3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide

C19H29N3O2 — CID 110420824

IUPAC3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide
SMILESCC(=O)NCCC(=O)NCC(Cc1ccccc1)N1CCCCC1
InChIInChI=1S/C19H29N3O2/c1-16(23)20-11-10-19(24)21-15-18(22-12-6-3-7-13-22)14-17-8-4-2-5-9-17/h2,4-5,8-9,18H,3,6-7,10-15H2,1H3,(H,20,23)(H,21,24)
InChIKeyALXMBMPCJISXML-UHFFFAOYSA-N
MW331.46 g/mol
LogP1.73
Rot. Bonds8

About 3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide

3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide (PubChem CID 110420824) has the molecular formula C19H29N3O2 and a molecular weight of 331.46 g/mol. Its IUPAC name is 3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide.

Molecular Properties

Compound Name3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide
PubChem CID110420824
Molecular FormulaC19H29N3O2
Molecular Weight331.46 g/mol
Exact Mass331.23
IUPAC Name3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide
SMILESCC(=O)NCCC(=O)NCC(Cc1ccccc1)N1CCCCC1
InChIInChI=1S/C19H29N3O2/c1-16(23)20-11-10-19(24)21-15-18(22-12-6-3-7-13-22)14-17-8-4-2-5-9-17/h2,4-5,8-9,18H,3,6-7,10-15H2,1H3,(H,20,23)(H,21,24)
InChIKeyALXMBMPCJISXML-UHFFFAOYSA-N
XLogP1.73
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-acetamido-N-(2-phenyl-2-piperidin-1-ylethyl)propanamide
CID 110355080
methyl N-(3-phenyl-2-piperidin-1-ylpropyl)carbamate
CID 110403986
N-(3-phenyl-2-piperidin-1-ylpropyl)cyclopropanecarboxamide
CID 110403968
1-benzyl-3-(3-phenyl-2-pyrrolidin-1-ylpropyl)urea
CID 110403915
3-(1,1-dioxothiolan-3-yl)-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide
CID 110617737
2-(2-methoxyphenoxy)-N-(3-phenyl-2-pyrrolidin-1-ylpropyl)acetamide
CID 110403913
2-cyclopropyl-N-(3-phenyl-2-pyrrolidin-1-ylpropyl)propanamide
CID 110611083
1-[(2S)-3-(4-hydroxyphenyl)-2-pyrrolidin-1-ylpropyl]-3-(2-phenylethyl)urea;methane
CID 159423751
N-(3-phenyl-2-pyrrolidin-1-ylpropyl)thiophene-2-carboxamide
CID 110403885
3-acetamido-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]propanamide
CID 110353373
3,3-dimethyl-N-[2-(4-methylpiperazin-1-yl)-3-phenylpropyl]butanamide
CID 110404076
N-[2-(4-methylpiperazin-1-yl)-3-phenylpropyl]cyclopentanecarboxamide
CID 110404018

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide?
The IUPAC name of 3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide (CID 110420824) is 3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide.
What is the SMILES notation for 3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide?
The canonical SMILES for 3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide is CC(=O)NCCC(=O)NCC(Cc1ccccc1)N1CCCCC1.
What is the InChIKey of 3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide?
The InChIKey is ALXMBMPCJISXML-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2/c1-16(23)20-11-10-19(24)21-15-18(22-12-6-3-7-13-22)14-17-8-4-2-5-9-17/h2,4-5,8-9,18H,3,6-7,10-15H2,1H3,(H,20,23)(H,21,24).
What are the key properties of 3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide?
3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide has a molecular weight of 331.46 g/mol, XLogP of 1.73, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide is sourced from PubChem (CID 110420824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).