(2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone

C11H14ClNO3 — CID 106687373

IUPAC(2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone
SMILESCOC1CCCN(C(=O)c2ccoc2Cl)C1
InChIInChI=1S/C11H14ClNO3/c1-15-8-3-2-5-13(7-8)11(14)9-4-6-16-10(9)12/h4,6,8H,2-3,5,7H2,1H3
InChIKeyHOQXHDQTFKSVGP-UHFFFAOYSA-N
MW243.69 g/mol
LogP2.18
Rot. Bonds2

About (2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone

(2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone (PubChem CID 106687373) has the molecular formula C11H14ClNO3 and a molecular weight of 243.69 g/mol. Its IUPAC name is (2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone.

Molecular Properties

Compound Name(2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone
PubChem CID106687373
Molecular FormulaC11H14ClNO3
Molecular Weight243.69 g/mol
Exact Mass243.07
IUPAC Name(2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone
SMILESCOC1CCCN(C(=O)c2ccoc2Cl)C1
InChIInChI=1S/C11H14ClNO3/c1-15-8-3-2-5-13(7-8)11(14)9-4-6-16-10(9)12/h4,6,8H,2-3,5,7H2,1H3
InChIKeyHOQXHDQTFKSVGP-UHFFFAOYSA-N
XLogP2.18
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.69
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl (3R)-1-(2-chlorofuran-3-carbonyl)piperidine-3-carboxylate
CID 106688676
(2-chlorofuran-3-yl)-[3-(methylaminomethyl)piperidin-1-yl]methanone
CID 106688448
(2-bromofuran-3-yl)-(3-methoxypyrrolidin-1-yl)methanone
CID 106854462
(2-chloro-4,5-difluorophenyl)-(3-methoxypiperidin-1-yl)methanone
CID 91830057
(4-chloro-6-methyl-3-pyridinyl)-(3-methoxypiperidin-1-yl)methanone
CID 103878889
(2-chlorofuran-3-yl)-[4-(dimethylamino)piperidin-1-yl]methanone
CID 106685458
(3-bromopyrrolidin-1-yl)-(2-chlorofuran-3-yl)methanone
CID 106689942
(2-chlorofuran-3-yl)-(4-chloro-3-methylpiperidin-1-yl)methanone
CID 106690201
(2-chlorofuran-3-yl)-(4-methylpiperidin-1-yl)methanone
CID 106685117
(2-chlorofuran-3-yl)-(3,4-dimethylpyrrolidin-1-yl)methanone
CID 106686990
(2-amino-3-pyridinyl)-(3-methoxypiperidin-1-yl)methanone
CID 102969309
(2-chlorofuran-3-yl)-(3-methylpiperazin-1-yl)methanone
CID 106683662

Frequently Asked Questions

What is the IUPAC name of (2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone?
The IUPAC name of (2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone (CID 106687373) is (2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone.
What is the SMILES notation for (2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone?
The canonical SMILES for (2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone is COC1CCCN(C(=O)c2ccoc2Cl)C1.
What is the InChIKey of (2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone?
The InChIKey is HOQXHDQTFKSVGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO3/c1-15-8-3-2-5-13(7-8)11(14)9-4-6-16-10(9)12/h4,6,8H,2-3,5,7H2,1H3.
What are the key properties of (2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone?
(2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone has a molecular weight of 243.69 g/mol, XLogP of 2.18, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone is sourced from PubChem (CID 106687373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).