1-(3-amino-2-phenylpropyl)piperidin-2-one

C14H20N2O — CID 64538651

IUPAC1-(3-amino-2-phenylpropyl)piperidin-2-one
SMILESNCC(CN1CCCCC1=O)c1ccccc1
InChIInChI=1S/C14H20N2O/c15-10-13(12-6-2-1-3-7-12)11-16-9-5-4-8-14(16)17/h1-3,6-7,13H,4-5,8-11,15H2
InChIKeyOLJWKYHQUJCGED-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.74
Rot. Bonds4

About 1-(3-amino-2-phenylpropyl)piperidin-2-one

1-(3-amino-2-phenylpropyl)piperidin-2-one (PubChem CID 64538651) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 1-(3-amino-2-phenylpropyl)piperidin-2-one.

Molecular Properties

Compound Name1-(3-amino-2-phenylpropyl)piperidin-2-one
PubChem CID64538651
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name1-(3-amino-2-phenylpropyl)piperidin-2-one
SMILESNCC(CN1CCCCC1=O)c1ccccc1
InChIInChI=1S/C14H20N2O/c15-10-13(12-6-2-1-3-7-12)11-16-9-5-4-8-14(16)17/h1-3,6-7,13H,4-5,8-11,15H2
InChIKeyOLJWKYHQUJCGED-UHFFFAOYSA-N
XLogP1.74
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-amino-2-phenylpropyl)morpholin-3-one
CID 79468237
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1-[3-amino-2-(2-hydroxyphenyl)propyl]pyrrolidin-2-one
CID 105494553
1-[3-amino-2-(2-fluorophenyl)propyl]pyrrolidin-2-one
CID 105497790
1-(3-amino-2-methylpropyl)piperidin-2-one
CID 43367864
N-(2-amino-2-phenylethyl)-2-(2-oxopiperidin-1-yl)acetamide
CID 119528982
2-amino-N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]acetamide;hydrochloride
CID 119287067
1-(3-hydroxy-3-phenylpropyl)azocan-2-one
CID 116693124
4-(3-amino-2-phenylpropyl)-1-methyl-1,4-diazepan-2-one
CID 102888622
N-(2-amino-2-phenylethyl)-2-(2-oxoazepan-1-yl)acetamide
CID 119528362
1-[2-amino-2-(4-propan-2-ylphenyl)ethyl]piperidin-2-one
CID 43212281
N-[2-(2-oxopiperidin-1-yl)ethyl]-2,2-diphenylacetamide
CID 110722740

Frequently Asked Questions

What is the IUPAC name of 1-(3-amino-2-phenylpropyl)piperidin-2-one?
The IUPAC name of 1-(3-amino-2-phenylpropyl)piperidin-2-one (CID 64538651) is 1-(3-amino-2-phenylpropyl)piperidin-2-one.
What is the SMILES notation for 1-(3-amino-2-phenylpropyl)piperidin-2-one?
The canonical SMILES for 1-(3-amino-2-phenylpropyl)piperidin-2-one is NCC(CN1CCCCC1=O)c1ccccc1.
What is the InChIKey of 1-(3-amino-2-phenylpropyl)piperidin-2-one?
The InChIKey is OLJWKYHQUJCGED-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c15-10-13(12-6-2-1-3-7-12)11-16-9-5-4-8-14(16)17/h1-3,6-7,13H,4-5,8-11,15H2.
What are the key properties of 1-(3-amino-2-phenylpropyl)piperidin-2-one?
1-(3-amino-2-phenylpropyl)piperidin-2-one has a molecular weight of 232.33 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-amino-2-phenylpropyl)piperidin-2-one is sourced from PubChem (CID 64538651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).