3-amino-N-(1-phenylpiperidin-3-yl)butanamide

C15H23N3O — CID 119888787

IUPAC3-amino-N-(1-phenylpiperidin-3-yl)butanamide
SMILESCC(N)CC(=O)NC1CCCN(c2ccccc2)C1
InChIInChI=1S/C15H23N3O/c1-12(16)10-15(19)17-13-6-5-9-18(11-13)14-7-3-2-4-8-14/h2-4,7-8,12-13H,5-6,9-11,16H2,1H3,(H,17,19)
InChIKeyAVLFJAGEOIUXTL-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.51
Rot. Bonds4

About 3-amino-N-(1-phenylpiperidin-3-yl)butanamide

3-amino-N-(1-phenylpiperidin-3-yl)butanamide (PubChem CID 119888787) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 3-amino-N-(1-phenylpiperidin-3-yl)butanamide.

Molecular Properties

Compound Name3-amino-N-(1-phenylpiperidin-3-yl)butanamide
PubChem CID119888787
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name3-amino-N-(1-phenylpiperidin-3-yl)butanamide
SMILESCC(N)CC(=O)NC1CCCN(c2ccccc2)C1
InChIInChI=1S/C15H23N3O/c1-12(16)10-15(19)17-13-6-5-9-18(11-13)14-7-3-2-4-8-14/h2-4,7-8,12-13H,5-6,9-11,16H2,1H3,(H,17,19)
InChIKeyAVLFJAGEOIUXTL-UHFFFAOYSA-N
XLogP1.51
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[1-(3-methoxyphenyl)piperidin-3-yl]butanamide
CID 119884246
3-amino-N-(1-phenylpiperidin-4-yl)butanamide;dihydrochloride
CID 119863025
3-amino-2-methyl-N-(1-phenylpiperidin-3-yl)butanamide;dihydrochloride
CID 120504040
2-[methyl(propan-2-yl)amino]-N-(1-phenylpiperidin-3-yl)acetamide
CID 136526077
3-amino-N-(1-benzylpiperidin-3-yl)butanamide;dihydrochloride
CID 119856024
(1-phenylpiperidin-3-yl)urea
CID 121416777
3-amino-N-(1-pyridazin-3-ylpiperidin-3-yl)butanamide;hydrochloride
CID 120872944
[(3R)-1-phenylpiperidin-3-yl]carbamic acid
CID 89499357
4-(methylamino)-N-(1-phenylpiperidin-3-yl)butanamide
CID 119888744
4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride
CID 120565548
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide
CID 119888772
2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-3-yl)acetamide;dihydrochloride
CID 120800731

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-phenylpiperidin-3-yl)butanamide?
The IUPAC name of 3-amino-N-(1-phenylpiperidin-3-yl)butanamide (CID 119888787) is 3-amino-N-(1-phenylpiperidin-3-yl)butanamide.
What is the SMILES notation for 3-amino-N-(1-phenylpiperidin-3-yl)butanamide?
The canonical SMILES for 3-amino-N-(1-phenylpiperidin-3-yl)butanamide is CC(N)CC(=O)NC1CCCN(c2ccccc2)C1.
What is the InChIKey of 3-amino-N-(1-phenylpiperidin-3-yl)butanamide?
The InChIKey is AVLFJAGEOIUXTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-12(16)10-15(19)17-13-6-5-9-18(11-13)14-7-3-2-4-8-14/h2-4,7-8,12-13H,5-6,9-11,16H2,1H3,(H,17,19).
What are the key properties of 3-amino-N-(1-phenylpiperidin-3-yl)butanamide?
3-amino-N-(1-phenylpiperidin-3-yl)butanamide has a molecular weight of 261.37 g/mol, XLogP of 1.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-phenylpiperidin-3-yl)butanamide is sourced from PubChem (CID 119888787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).