(3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide

C23H29N3O3 — CID 26393459

IUPAC(3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide
SMILESO=C(NCc1ccccc1)[C@@H]1CCCN(C2CCN(C(=O)c3ccoc3)CC2)C1
InChIInChI=1S/C23H29N3O3/c27-22(24-15-18-5-2-1-3-6-18)19-7-4-11-26(16-19)21-8-12-25(13-9-21)23(28)20-10-14-29-17-20/h1-3,5-6,10,14,17,19,21H,4,7-9,11-13,15-16H2,(H,24,27)/t19-/m1/s1
InChIKeyPAJGSJYDUUGDKQ-LJQANCHMSA-N
MW395.50 g/mol
LogP2.91
Rot. Bonds5

About (3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide

(3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide (PubChem CID 26393459) has the molecular formula C23H29N3O3 and a molecular weight of 395.50 g/mol. Its IUPAC name is (3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide
PubChem CID26393459
Molecular FormulaC23H29N3O3
Molecular Weight395.50 g/mol
Exact Mass395.22
IUPAC Name(3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide
SMILESO=C(NCc1ccccc1)[C@@H]1CCCN(C2CCN(C(=O)c3ccoc3)CC2)C1
InChIInChI=1S/C23H29N3O3/c27-22(24-15-18-5-2-1-3-6-18)19-7-4-11-26(16-19)21-8-12-25(13-9-21)23(28)20-10-14-29-17-20/h1-3,5-6,10,14,17,19,21H,4,7-9,11-13,15-16H2,(H,24,27)/t19-/m1/s1
InChIKeyPAJGSJYDUUGDKQ-LJQANCHMSA-N
XLogP2.91
TPSA65.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.50
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 3620848
1-[1-(pyridine-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 70721657
(3R)-N-[[4-(carbamoylamino)phenyl]methyl]-1-(furan-3-carbonyl)piperidine-3-carboxamide
CID 51725834
N-benzyl-1-(furan-3-carbonyl)piperidine-2-carboxamide
CID 5019016
(2R)-N-benzyl-1-(furan-3-carbonyl)piperidine-2-carboxamide
CID 815025
(3S)-N-benzyl-1-[1-(pyridin-4-ylmethyl)piperidin-4-yl]piperidine-3-carboxamide
CID 25288590
1-(1-benzylpiperidin-4-yl)-N-(pyridin-4-ylmethyl)piperidine-3-carboxamide
CID 45169933
(3S)-N-ethyl-1-(furan-3-carbonyl)piperidine-3-carboxamide
CID 30830527
(2S)-2-[[(3S)-1-(furan-3-carbonyl)piperidine-3-carbonyl]amino]-2-methyl-3-phenylpropanoic acid
CID 97324282
1-(1-acetylpiperidin-4-yl)-N-(2-phenylethyl)piperidine-3-carboxamide
CID 45221291
(3S)-1-[1-(pyridazine-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 95552529
N-benzyl-1-[1-(3-methylsulfanylpropyl)piperidin-4-yl]piperidine-3-carboxamide
CID 45217294

Frequently Asked Questions

What is the IUPAC name of (3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide?
The IUPAC name of (3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide (CID 26393459) is (3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide is O=C(NCc1ccccc1)[C@@H]1CCCN(C2CCN(C(=O)c3ccoc3)CC2)C1.
What is the InChIKey of (3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide?
The InChIKey is PAJGSJYDUUGDKQ-LJQANCHMSA-N. The full InChI is InChI=1S/C23H29N3O3/c27-22(24-15-18-5-2-1-3-6-18)19-7-4-11-26(16-19)21-8-12-25(13-9-21)23(28)20-10-14-29-17-20/h1-3,5-6,10,14,17,19,21H,4,7-9,11-13,15-16H2,(H,24,27)/t19-/m1/s1.
What are the key properties of (3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide?
(3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide has a molecular weight of 395.50 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide is sourced from PubChem (CID 26393459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).