1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one

C15H23N3O — CID 43396360

IUPAC1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one
SMILESCC(NC(C)c1cccnc1)C(=O)N1CCCCC1
InChIInChI=1S/C15H23N3O/c1-12(14-7-6-8-16-11-14)17-13(2)15(19)18-9-4-3-5-10-18/h6-8,11-13,17H,3-5,9-10H2,1-2H3
InChIKeyLBSRCAREMIJGLW-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.13
Rot. Bonds4

About 1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one

1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one (PubChem CID 43396360) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one.

Molecular Properties

Compound Name1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one
PubChem CID43396360
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one
SMILESCC(NC(C)c1cccnc1)C(=O)N1CCCCC1
InChIInChI=1S/C15H23N3O/c1-12(14-7-6-8-16-11-14)17-13(2)15(19)18-9-4-3-5-10-18/h6-8,11-13,17H,3-5,9-10H2,1-2H3
InChIKeyLBSRCAREMIJGLW-UHFFFAOYSA-N
XLogP2.13
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(1R)-1-pyridin-3-ylethyl]amino]-1-pyrrolidin-1-ylethanone
CID 81404885
1-(azepan-1-yl)-2-[[(1S)-1-(3-fluorophenyl)ethyl]amino]propan-1-one
CID 81353078
N-propan-2-yl-2-[[(1R)-1-pyridin-3-ylethyl]amino]propanamide
CID 81404015
2-(1-pyrazin-2-ylethylamino)-1-pyrrolidin-1-ylpropan-1-one
CID 112551234
1-(azepan-1-yl)-2-[1-(4-fluorophenyl)ethylamino]propan-1-one
CID 60676626
N-methyl-2-[[(1S)-1-pyridin-3-ylethyl]amino]propanamide
CID 81404603
N-[(1S)-2-methyl-1-pyridin-3-ylpropyl]azocane-1-carboxamide
CID 125442514
(1S)-1-phenyl-N-[(1S)-1-pyridin-3-ylethyl]ethanamine
CID 11413502
1-(azepan-1-yl)-2-[1-(2-chlorophenyl)ethylamino]propan-1-one
CID 60676820
2-methyl-1-[4-(1-pyridin-3-ylethyl)piperazin-1-yl]propan-1-one
CID 87038067
2-amino-3-hydroxy-3-pyridin-3-yl-1-pyrrolidin-1-ylpropan-1-one
CID 50940502
1-(azepan-1-yl)-2-[1-(furan-2-yl)ethylamino]propan-1-one
CID 43401218

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one?
The IUPAC name of 1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one (CID 43396360) is 1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one.
What is the SMILES notation for 1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one?
The canonical SMILES for 1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one is CC(NC(C)c1cccnc1)C(=O)N1CCCCC1.
What is the InChIKey of 1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one?
The InChIKey is LBSRCAREMIJGLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-12(14-7-6-8-16-11-14)17-13(2)15(19)18-9-4-3-5-10-18/h6-8,11-13,17H,3-5,9-10H2,1-2H3.
What are the key properties of 1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one?
1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one has a molecular weight of 261.37 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-1-yl-2-(1-pyridin-3-ylethylamino)propan-1-one is sourced from PubChem (CID 43396360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).