(3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide

C24H25N3O5 — CID 51933799

IUPAC(3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide
SMILESO=C(CN(Cc1ccco1)C(=O)[C@@H]1CCCN(C(=O)c2ccoc2)C1)Nc1ccccc1
InChIInChI=1S/C24H25N3O5/c28-22(25-20-7-2-1-3-8-20)16-27(15-21-9-5-12-32-21)23(29)18-6-4-11-26(14-18)24(30)19-10-13-31-17-19/h1-3,5,7-10,12-13,17-18H,4,6,11,14-16H2,(H,25,28)/t18-/m1/s1
InChIKeyRCRVVEFNMIOFBX-GOSISDBHSA-N
MW435.48 g/mol
LogP3.39
Rot. Bonds7

About (3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide

(3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide (PubChem CID 51933799) has the molecular formula C24H25N3O5 and a molecular weight of 435.48 g/mol. Its IUPAC name is (3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide
PubChem CID51933799
Molecular FormulaC24H25N3O5
Molecular Weight435.48 g/mol
Exact Mass435.18
IUPAC Name(3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide
SMILESO=C(CN(Cc1ccco1)C(=O)[C@@H]1CCCN(C(=O)c2ccoc2)C1)Nc1ccccc1
InChIInChI=1S/C24H25N3O5/c28-22(25-20-7-2-1-3-8-20)16-27(15-21-9-5-12-32-21)23(29)18-6-4-11-26(14-18)24(30)19-10-13-31-17-19/h1-3,5,7-10,12-13,17-18H,4,6,11,14-16H2,(H,25,28)/t18-/m1/s1
InChIKeyRCRVVEFNMIOFBX-GOSISDBHSA-N
XLogP3.39
TPSA96.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.48
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide with MolForge

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Related Compounds

(3S)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide
CID 51933773
N-(2-anilino-2-oxoethyl)-N-(furan-2-ylmethyl)cyclohex-3-ene-1-carboxamide
CID 43034035
N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide
CID 43054894
1-(furan-3-carbonyl)-N-methyl-N-[(2-methylphenyl)methyl]piperidine-3-carboxamide
CID 43056974
1-(furan-3-carbonyl)-N,N-dimethylpiperidine-3-carboxamide
CID 42891354
1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)-N-methylpiperidine-4-carboxamide
CID 35699759
(3S)-1-[2-[N-(furan-2-ylmethyl)anilino]acetyl]piperidine-3-carboxamide
CID 97215200
N-(2-benzylphenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide
CID 46569506
N-(furan-2-ylmethyl)-N-[2-[[2-(3-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]cyclohexanecarboxamide
CID 3686733
2-[furan-2-ylmethyl-[(3S)-3-methylpiperidin-1-yl]sulfonylamino]-N-phenylacetamide
CID 35317281
(3S)-3-N-(furan-2-ylmethyl)-1-N-phenylpiperidine-1,3-dicarboxamide
CID 7435298
N-(furan-2-ylmethyl)-N-[[4-(methylcarbamoyl)phenyl]methyl]-1-(2-phenylacetyl)piperidine-3-carboxamide
CID 46546153

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide (CID 51933799) is (3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide is O=C(CN(Cc1ccco1)C(=O)[C@@H]1CCCN(C(=O)c2ccoc2)C1)Nc1ccccc1.
What is the InChIKey of (3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide?
The InChIKey is RCRVVEFNMIOFBX-GOSISDBHSA-N. The full InChI is InChI=1S/C24H25N3O5/c28-22(25-20-7-2-1-3-8-20)16-27(15-21-9-5-12-32-21)23(29)18-6-4-11-26(14-18)24(30)19-10-13-31-17-19/h1-3,5,7-10,12-13,17-18H,4,6,11,14-16H2,(H,25,28)/t18-/m1/s1.
What are the key properties of (3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide?
(3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide has a molecular weight of 435.48 g/mol, XLogP of 3.39, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(2-anilino-2-oxoethyl)-1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 51933799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).