2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide

C11H15ClN2O2 — CID 106688438

IUPAC2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide
SMILESCN(C(=O)c1ccoc1Cl)C1CCNCC1
InChIInChI=1S/C11H15ClN2O2/c1-14(8-2-5-13-6-3-8)11(15)9-4-7-16-10(9)12/h4,7-8,13H,2-3,5-6H2,1H3
InChIKeyBQSBQRZTYPEVPT-UHFFFAOYSA-N
MW242.71 g/mol
LogP1.76
Rot. Bonds2

About 2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide

2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide (PubChem CID 106688438) has the molecular formula C11H15ClN2O2 and a molecular weight of 242.71 g/mol. Its IUPAC name is 2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide
PubChem CID106688438
Molecular FormulaC11H15ClN2O2
Molecular Weight242.71 g/mol
Exact Mass242.08
IUPAC Name2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide
SMILESCN(C(=O)c1ccoc1Cl)C1CCNCC1
InChIInChI=1S/C11H15ClN2O2/c1-14(8-2-5-13-6-3-8)11(15)9-4-7-16-10(9)12/h4,7-8,13H,2-3,5-6H2,1H3
InChIKeyBQSBQRZTYPEVPT-UHFFFAOYSA-N
XLogP1.76
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.71
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide
CID 106855036
2-chloro-N-[(3R,4R)-4-hydroxypyrrolidin-3-yl]-N-methylfuran-3-carboxamide
CID 106688427
2-chloro-N-methyl-N-(thiolan-3-yl)furan-3-carboxamide
CID 106685400
2,4-dichloro-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119444290
N-(azepan-4-yl)-2-chloro-N-methylbenzamide
CID 104974708
2-chloro-4,5-difluoro-N-methyl-N-piperidin-4-ylbenzamide
CID 119443353
N-(2-adamantyl)-2-chloro-N-methylfuran-3-carboxamide
CID 106686283
5-chloro-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide
CID 62277462
2,3,4-trifluoro-N-methyl-N-piperidin-4-ylbenzamide
CID 79750025
4-chloro-3-fluoro-N-methyl-N-piperidin-4-ylbenzamide
CID 107990085
2-chloro-N-methyl-5-nitro-N-piperidin-4-ylbenzamide
CID 43602219
N-(azepan-4-yl)-5-chloro-2-hydroxy-N-methylbenzamide
CID 107172538

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide?
The IUPAC name of 2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide (CID 106688438) is 2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide.
What is the SMILES notation for 2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide?
The canonical SMILES for 2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide is CN(C(=O)c1ccoc1Cl)C1CCNCC1.
What is the InChIKey of 2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide?
The InChIKey is BQSBQRZTYPEVPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O2/c1-14(8-2-5-13-6-3-8)11(15)9-4-7-16-10(9)12/h4,7-8,13H,2-3,5-6H2,1H3.
What are the key properties of 2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide?
2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide has a molecular weight of 242.71 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide is sourced from PubChem (CID 106688438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).