3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide

C15H21N3O2 — CID 45225552

IUPAC3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide
SMILESNC(=O)CCC1CCCN(C(=O)Cc2cccnc2)C1
InChIInChI=1S/C15H21N3O2/c16-14(19)6-5-12-4-2-8-18(11-12)15(20)9-13-3-1-7-17-10-13/h1,3,7,10,12H,2,4-6,8-9,11H2,(H2,16,19)
InChIKeyRQISFWPHIMLAFJ-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.13
Rot. Bonds5

About 3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide

3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide (PubChem CID 45225552) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide.

Molecular Properties

Compound Name3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide
PubChem CID45225552
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide
SMILESNC(=O)CCC1CCCN(C(=O)Cc2cccnc2)C1
InChIInChI=1S/C15H21N3O2/c16-14(19)6-5-12-4-2-8-18(11-12)15(20)9-13-3-1-7-17-10-13/h1,3,7,10,12H,2,4-6,8-9,11H2,(H2,16,19)
InChIKeyRQISFWPHIMLAFJ-UHFFFAOYSA-N
XLogP1.13
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-[2-(3-hydroxyphenyl)acetyl]piperidin-3-yl]propanamide
CID 70734679
1-[3-(methylaminomethyl)piperidin-1-yl]-2-pyridin-3-ylethanone
CID 62691421
2-pyridin-3-yl-1-[3-[2-[2-(trifluoromethyl)phenyl]ethyl]piperidin-1-yl]ethanone
CID 56881048
N-(3,5-dimethoxyphenyl)-3-[(3R)-1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide
CID 42517122
N-[(3-methoxyphenyl)methyl]-3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide
CID 45218064
2-hydroxy-1-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]ethanone
CID 95841872
1-(3-pyridazin-3-yloxypiperidin-1-yl)-2-pyridin-3-ylethanone
CID 91627703
1-[3-(methylaminomethyl)piperidin-1-yl]-3-pyridin-3-ylpropan-1-one
CID 78981202
1-(4-amino-3-methylpiperidin-1-yl)-2-pyridin-3-ylethanone
CID 79879332
1-[3-[(2S)-2-methylpiperidin-1-yl]azetidin-1-yl]-2-pyridin-3-ylethanone
CID 96582023
1-[3-[1-(2-hydroxyethyl)pyrazol-3-yl]piperidin-1-yl]-2-pyridin-3-ylethanone
CID 119064677
1-[3-(4-propan-2-yl-1,2,4-triazol-3-yl)piperidin-1-yl]-2-pyridin-3-ylethanone
CID 53192805

Frequently Asked Questions

What is the IUPAC name of 3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide?
The IUPAC name of 3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide (CID 45225552) is 3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide.
What is the SMILES notation for 3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide?
The canonical SMILES for 3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide is NC(=O)CCC1CCCN(C(=O)Cc2cccnc2)C1.
What is the InChIKey of 3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide?
The InChIKey is RQISFWPHIMLAFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c16-14(19)6-5-12-4-2-8-18(11-12)15(20)9-13-3-1-7-17-10-13/h1,3,7,10,12H,2,4-6,8-9,11H2,(H2,16,19).
What are the key properties of 3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide?
3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide has a molecular weight of 275.35 g/mol, XLogP of 1.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide is sourced from PubChem (CID 45225552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).