2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide

C10H9ClN2O2 — CID 106685763

IUPAC2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide
SMILESN#CC1(NC(=O)c2ccoc2Cl)CCC1
InChIInChI=1S/C10H9ClN2O2/c11-8-7(2-5-15-8)9(14)13-10(6-12)3-1-4-10/h2,5H,1,3-4H2,(H,13,14)
InChIKeyUYGAXCZBQUCQIN-UHFFFAOYSA-N
MW224.65 g/mol
LogP2.11
Rot. Bonds2

About 2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide

2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide (PubChem CID 106685763) has the molecular formula C10H9ClN2O2 and a molecular weight of 224.65 g/mol. Its IUPAC name is 2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide
PubChem CID106685763
Molecular FormulaC10H9ClN2O2
Molecular Weight224.65 g/mol
Exact Mass224.04
IUPAC Name2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide
SMILESN#CC1(NC(=O)c2ccoc2Cl)CCC1
InChIInChI=1S/C10H9ClN2O2/c11-8-7(2-5-15-8)9(14)13-10(6-12)3-1-4-10/h2,5H,1,3-4H2,(H,13,14)
InChIKeyUYGAXCZBQUCQIN-UHFFFAOYSA-N
XLogP2.11
TPSA66.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.65
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide
CID 60704628
5-bromo-2-chloro-N-(1-cyanocyclobutyl)benzamide
CID 54912686
5-amino-2-chloro-N-(1-cyanocyclohexyl)benzamide
CID 110473984
N-(1-cyanocyclooctyl)furan-2-carboxamide
CID 54904517
4-chloro-N-(1-cyanocyclohexyl)-2-hydroxybenzamide
CID 60717137
6-chloro-N-(1-cyanocyclopentyl)pyridazine-3-carboxamide
CID 114036737
2-chloro-N-[(1-hydroxycyclohexyl)methyl]furan-3-carboxamide
CID 106686927
4-amino-2-chloro-N-(1-cyanocyclohexyl)benzamide
CID 110474001
5-chloro-N-(1-cyanocyclohexyl)-2-iodobenzamide
CID 86986055
4-chloro-N-(1-cyanocyclohexyl)pyridine-2-carboxamide
CID 78831230
2-chloro-N-(3-methyloxan-3-yl)furan-3-carboxamide
CID 106812547
4-chloro-N-(1-cyanocyclopentyl)-6-methylpyridine-3-carboxamide
CID 103893850

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide?
The IUPAC name of 2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide (CID 106685763) is 2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide is N#CC1(NC(=O)c2ccoc2Cl)CCC1.
What is the InChIKey of 2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide?
The InChIKey is UYGAXCZBQUCQIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O2/c11-8-7(2-5-15-8)9(14)13-10(6-12)3-1-4-10/h2,5H,1,3-4H2,(H,13,14).
What are the key properties of 2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide?
2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide has a molecular weight of 224.65 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide is sourced from PubChem (CID 106685763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).