3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide

C19H23N3O3 — CID 131948015

IUPAC3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide
SMILESCc1ccoc1C(=O)NCC1CCCN(C(=O)Cc2cccnc2)C1
InChIInChI=1S/C19H23N3O3/c1-14-6-9-25-18(14)19(24)21-12-16-5-3-8-22(13-16)17(23)10-15-4-2-7-20-11-15/h2,4,6-7,9,11,16H,3,5,8,10,12-13H2,1H3,(H,21,24)
InChIKeyZPLPENXCTSRLPH-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.19
Rot. Bonds5

About 3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide

3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide (PubChem CID 131948015) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide
PubChem CID131948015
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide
SMILESCc1ccoc1C(=O)NCC1CCCN(C(=O)Cc2cccnc2)C1
InChIInChI=1S/C19H23N3O3/c1-14-6-9-25-18(14)19(24)21-12-16-5-3-8-22(13-16)17(23)10-15-4-2-7-20-11-15/h2,4,6-7,9,11,16H,3,5,8,10,12-13H2,1H3,(H,21,24)
InChIKeyZPLPENXCTSRLPH-UHFFFAOYSA-N
XLogP2.19
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide with MolForge

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Related Compounds

1-[3-(methylaminomethyl)piperidin-1-yl]-2-pyridin-3-ylethanone
CID 62691421
3-methyl-N-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]furan-2-carboxamide
CID 131952335
N-[[1-[3-(2,4-dioxopyrimidin-1-yl)propanoyl]piperidin-3-yl]methyl]-3-methylfuran-2-carboxamide
CID 131920487
2,6-dimethyl-N-[[(3S)-1-(pyridin-3-ylmethyl)piperidin-3-yl]methyl]benzamide
CID 97227448
3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide
CID 45225552
1-[3-(methylaminomethyl)piperidin-1-yl]-3-pyridin-3-ylpropan-1-one
CID 78981202
N-[(3-methoxyphenyl)methyl]-3-[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]propanamide
CID 45218064
1-[(3S)-3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]-2-pyridin-3-ylethanone
CID 95845191
N-[[1-[2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetyl]piperidin-3-yl]methyl]pyridine-3-carboxamide
CID 72837742
2-hydroxy-1-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]ethanone
CID 95841872
1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyridin-3-ylethanone
CID 81208117
1-[3-(4-fluoroanilino)piperidin-1-yl]-2-pyridin-3-ylethanone
CID 45251610

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide?
The IUPAC name of 3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide (CID 131948015) is 3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide.
What is the SMILES notation for 3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide?
The canonical SMILES for 3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide is Cc1ccoc1C(=O)NCC1CCCN(C(=O)Cc2cccnc2)C1.
What is the InChIKey of 3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide?
The InChIKey is ZPLPENXCTSRLPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-14-6-9-25-18(14)19(24)21-12-16-5-3-8-22(13-16)17(23)10-15-4-2-7-20-11-15/h2,4,6-7,9,11,16H,3,5,8,10,12-13H2,1H3,(H,21,24).
What are the key properties of 3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide?
3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[[1-(2-pyridin-3-ylacetyl)piperidin-3-yl]methyl]furan-2-carboxamide is sourced from PubChem (CID 131948015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).