(3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide

C13H18N2O4 — CID 70330321

IUPAC(3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide
SMILESO=C(C[C@@H](O)C(=O)N1CCCC1)NCc1ccco1
InChIInChI=1S/C13H18N2O4/c16-11(13(18)15-5-1-2-6-15)8-12(17)14-9-10-4-3-7-19-10/h3-4,7,11,16H,1-2,5-6,8-9H2,(H,14,17)/t11-/m1/s1
InChIKeyAKDZBMCQRYZYEB-LLVKDONJSA-N
MW266.30 g/mol
LogP0.27
Rot. Bonds5

About (3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide

(3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide (PubChem CID 70330321) has the molecular formula C13H18N2O4 and a molecular weight of 266.30 g/mol. Its IUPAC name is (3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide.

Molecular Properties

Compound Name(3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide
PubChem CID70330321
Molecular FormulaC13H18N2O4
Molecular Weight266.30 g/mol
Exact Mass266.13
IUPAC Name(3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide
SMILESO=C(C[C@@H](O)C(=O)N1CCCC1)NCc1ccco1
InChIInChI=1S/C13H18N2O4/c16-11(13(18)15-5-1-2-6-15)8-12(17)14-9-10-4-3-7-19-10/h3-4,7,11,16H,1-2,5-6,8-9H2,(H,14,17)/t11-/m1/s1
InChIKeyAKDZBMCQRYZYEB-LLVKDONJSA-N
XLogP0.27
TPSA82.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(azepan-1-yl)-N-(furan-2-ylmethyl)-3-oxopropanamide
CID 108945088
N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide
CID 865161
(2S)-1-[(2R)-4-(furan-2-ylmethylamino)-2-hydroxy-4-oxobutanoyl]-N-phenylpyrrolidine-2-carboxamide
CID 70329798
2-(furan-2-ylmethylamino)-1-piperidin-1-ylpropan-1-one
CID 43083284
N-(furan-2-ylmethyl)-4-(pyrrolidine-1-carbonyl)benzamide
CID 109044221
N-(furan-2-ylmethyl)-2-pyrrolidin-1-yl-2-sulfanylideneacetamide
CID 2975846
3-(azepan-1-yl)-N-(furan-2-ylmethyl)propanamide
CID 109018473
N-(furan-2-ylmethyl)-3-piperidin-1-ylpropanamide
CID 110688280
3-amino-N-(furan-2-ylmethyl)butanamide
CID 60835501
N-(furan-2-ylmethyl)-3,3-diphenylpropanamide
CID 2259031
[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl] 2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanylbenzoate
CID 7638445
N-(furan-2-ylmethyl)-2,2-dimethyl-3-oxo-3-piperidin-1-ylpropanamide
CID 108958739

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide?
The IUPAC name of (3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide (CID 70330321) is (3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide.
What is the SMILES notation for (3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide?
The canonical SMILES for (3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide is O=C(C[C@@H](O)C(=O)N1CCCC1)NCc1ccco1.
What is the InChIKey of (3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide?
The InChIKey is AKDZBMCQRYZYEB-LLVKDONJSA-N. The full InChI is InChI=1S/C13H18N2O4/c16-11(13(18)15-5-1-2-6-15)8-12(17)14-9-10-4-3-7-19-10/h3-4,7,11,16H,1-2,5-6,8-9H2,(H,14,17)/t11-/m1/s1.
What are the key properties of (3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide?
(3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide has a molecular weight of 266.30 g/mol, XLogP of 0.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(furan-2-ylmethyl)-3-hydroxy-4-oxo-4-pyrrolidin-1-ylbutanamide is sourced from PubChem (CID 70330321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).