3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide

C15H20N4O — CID 102985639

IUPAC3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide
SMILESN#Cc1ccc(NC(=O)CCN2CCC[C@@H](N)C2)cc1
InChIInChI=1S/C15H20N4O/c16-10-12-3-5-14(6-4-12)18-15(20)7-9-19-8-1-2-13(17)11-19/h3-6,13H,1-2,7-9,11,17H2,(H,18,20)/t13-/m1/s1
InChIKeyWASNWNCFUNSGRZ-CYBMUJFWSA-N
MW272.35 g/mol
LogP1.31
Rot. Bonds4

About 3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide

3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide (PubChem CID 102985639) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide.

Molecular Properties

Compound Name3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide
PubChem CID102985639
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide
SMILESN#Cc1ccc(NC(=O)CCN2CCC[C@@H](N)C2)cc1
InChIInChI=1S/C15H20N4O/c16-10-12-3-5-14(6-4-12)18-15(20)7-9-19-8-1-2-13(17)11-19/h3-6,13H,1-2,7-9,11,17H2,(H,18,20)/t13-/m1/s1
InChIKeyWASNWNCFUNSGRZ-CYBMUJFWSA-N
XLogP1.31
TPSA82.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-cyanophenyl)-3-[3-(hydroxymethyl)piperidin-1-yl]propanamide
CID 43421973
3-(azocan-1-yl)-N-(4-cyanophenyl)propanamide
CID 28801310
N-(4-cyanophenyl)-3-[(3S)-3-hydroxypyrrolidin-1-yl]propanamide
CID 78962066
3-(4-amino-3-methylpiperidin-1-yl)-N-(4-cyanophenyl)propanamide
CID 79874391
(3R)-1-[3-(4-cyanoanilino)-3-oxopropyl]-N-phenylpiperidine-3-carboxamide
CID 25471392
N-(4-cyanophenyl)-3-[4-(hydroxymethyl)piperidin-1-yl]propanamide
CID 43246129
N-(4-cyanophenyl)-3-(1,4-oxazepan-4-yl)propanamide
CID 62058920
N-(4-cyanophenyl)-3-(2-methylpyrrolidin-1-yl)propanamide
CID 54882625
N-(4-cyanophenyl)-3-(4-methoxypiperidin-1-yl)propanamide
CID 43243966
N-(4-cyanophenyl)-2-(3-hydroxypiperidin-1-yl)acetamide
CID 60642377
N-(4-cyanophenyl)-2-(3-ethylpiperidin-1-yl)acetamide
CID 43430359
3-(4-acetylpiperazin-1-yl)-N-(4-cyanophenyl)propanamide
CID 28793141

Frequently Asked Questions

What is the IUPAC name of 3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide?
The IUPAC name of 3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide (CID 102985639) is 3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide.
What is the SMILES notation for 3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide?
The canonical SMILES for 3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide is N#Cc1ccc(NC(=O)CCN2CCC[C@@H](N)C2)cc1.
What is the InChIKey of 3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide?
The InChIKey is WASNWNCFUNSGRZ-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H20N4O/c16-10-12-3-5-14(6-4-12)18-15(20)7-9-19-8-1-2-13(17)11-19/h3-6,13H,1-2,7-9,11,17H2,(H,18,20)/t13-/m1/s1.
What are the key properties of 3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide?
3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide has a molecular weight of 272.35 g/mol, XLogP of 1.31, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3R)-3-aminopiperidin-1-yl]-N-(4-cyanophenyl)propanamide is sourced from PubChem (CID 102985639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).