[(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone

C12H18N2O2 — CID 102978338

IUPAC[(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone
SMILESCCc1ccc(C(=O)N2CCC[C@@H](N)C2)o1
InChIInChI=1S/C12H18N2O2/c1-2-10-5-6-11(16-10)12(15)14-7-3-4-9(13)8-14/h5-6,9H,2-4,7-8,13H2,1H3/t9-/m1/s1
InChIKeyAPTPJOXPXVDEJS-SECBINFHSA-N
MW222.29 g/mol
LogP1.41
Rot. Bonds2

About [(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone

[(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone (PubChem CID 102978338) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is [(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone.

Molecular Properties

Compound Name[(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone
PubChem CID102978338
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name[(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone
SMILESCCc1ccc(C(=O)N2CCC[C@@H](N)C2)o1
InChIInChI=1S/C12H18N2O2/c1-2-10-5-6-11(16-10)12(15)14-7-3-4-9(13)8-14/h5-6,9H,2-4,7-8,13H2,1H3/t9-/m1/s1
InChIKeyAPTPJOXPXVDEJS-SECBINFHSA-N
XLogP1.41
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone 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

(3-aminopyrrolidin-1-yl)-(5-ethylfuran-2-yl)methanone
CID 79094746
(5-ethylfuran-2-yl)-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]methanone
CID 79095324
[3-(bromomethyl)pyrrolidin-1-yl]-(5-ethylfuran-2-yl)methanone
CID 80667487
(3-aminopiperidin-1-yl)-[5-[(4-bromophenoxy)methyl]furan-2-yl]methanone
CID 119379806
[(3S)-3-aminopiperidin-1-yl]-[5-[(4-fluorophenoxy)methyl]furan-2-yl]methanone
CID 124628175
tert-butyl N-[[1-(5-ethylfuran-2-carbonyl)piperidin-3-yl]methyl]-N-methylcarbamate
CID 47796215
(5-ethylfuran-2-yl)-[(3R)-3-(5-ethyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone
CID 95221622
(3-aminopiperidin-1-yl)-[5-(naphthalen-2-yloxymethyl)furan-2-yl]methanone;hydrochloride
CID 119377660
[(3R)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)piperidin-1-yl]-(5-ethylfuran-2-yl)methanone
CID 95737072
1-(3-aminopiperidin-1-yl)-3-(4-ethylphenyl)propan-1-one
CID 115277223
(5-ethylfuran-2-yl)-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 79028614
1-(5-ethylfuran-2-carbonyl)piperidin-4-one
CID 79095458

Frequently Asked Questions

What is the IUPAC name of [(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone?
The IUPAC name of [(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone (CID 102978338) is [(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone.
What is the SMILES notation for [(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone?
The canonical SMILES for [(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone is CCc1ccc(C(=O)N2CCC[C@@H](N)C2)o1.
What is the InChIKey of [(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone?
The InChIKey is APTPJOXPXVDEJS-SECBINFHSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-2-10-5-6-11(16-10)12(15)14-7-3-4-9(13)8-14/h5-6,9H,2-4,7-8,13H2,1H3/t9-/m1/s1.
What are the key properties of [(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone?
[(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone has a molecular weight of 222.29 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-aminopiperidin-1-yl]-(5-ethylfuran-2-yl)methanone is sourced from PubChem (CID 102978338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).