2-chloro-N-propylfuran-3-carboxamide

C8H10ClNO2 — CID 106685121

IUPAC2-chloro-N-propylfuran-3-carboxamide
SMILESCCCNC(=O)c1ccoc1Cl
InChIInChI=1S/C8H10ClNO2/c1-2-4-10-8(11)6-3-5-12-7(6)9/h3,5H,2,4H2,1H3,(H,10,11)
InChIKeyVBXRBUIXSWYEAN-UHFFFAOYSA-N
MW187.63 g/mol
LogP2.07
Rot. Bonds3

About 2-chloro-N-propylfuran-3-carboxamide

2-chloro-N-propylfuran-3-carboxamide (PubChem CID 106685121) has the molecular formula C8H10ClNO2 and a molecular weight of 187.63 g/mol. Its IUPAC name is 2-chloro-N-propylfuran-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-propylfuran-3-carboxamide
PubChem CID106685121
Molecular FormulaC8H10ClNO2
Molecular Weight187.63 g/mol
Exact Mass187.04
IUPAC Name2-chloro-N-propylfuran-3-carboxamide
SMILESCCCNC(=O)c1ccoc1Cl
InChIInChI=1S/C8H10ClNO2/c1-2-4-10-8(11)6-3-5-12-7(6)9/h3,5H,2,4H2,1H3,(H,10,11)
InChIKeyVBXRBUIXSWYEAN-UHFFFAOYSA-N
XLogP2.07
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.63
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide
CID 106685261
2-chloro-N-(3,3-dimethylbutyl)furan-3-carboxamide
CID 106687305
2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide
CID 106685876
2-chloro-N-(3-methylsulfinylpropyl)furan-3-carboxamide
CID 106687268
N-(5-amino-5-oxopentyl)-2-chlorofuran-3-carboxamide
CID 106812546
2-chloro-N-pent-4-ynylfuran-3-carboxamide
CID 106812151
2-chloro-N-[2-(cyclopropanecarbonylamino)ethyl]furan-3-carboxamide
CID 106687261
2-chloro-N-[2-(2-methylpropoxy)ethyl]furan-3-carboxamide
CID 106687325
2-chloro-N-(3-methyl-2-oxobutyl)furan-3-carboxamide
CID 106685015
N-(2-aminopropyl)-2-chlorofuran-3-carboxamide
CID 106688502
N-(2-bromopropyl)-2-chlorofuran-3-carboxamide
CID 106690037
2-chloro-N-[2-[2-(dimethylamino)ethoxy]ethyl]furan-3-carboxamide
CID 106812685

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-propylfuran-3-carboxamide?
The IUPAC name of 2-chloro-N-propylfuran-3-carboxamide (CID 106685121) is 2-chloro-N-propylfuran-3-carboxamide.
What is the SMILES notation for 2-chloro-N-propylfuran-3-carboxamide?
The canonical SMILES for 2-chloro-N-propylfuran-3-carboxamide is CCCNC(=O)c1ccoc1Cl.
What is the InChIKey of 2-chloro-N-propylfuran-3-carboxamide?
The InChIKey is VBXRBUIXSWYEAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClNO2/c1-2-4-10-8(11)6-3-5-12-7(6)9/h3,5H,2,4H2,1H3,(H,10,11).
What are the key properties of 2-chloro-N-propylfuran-3-carboxamide?
2-chloro-N-propylfuran-3-carboxamide has a molecular weight of 187.63 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-propylfuran-3-carboxamide is sourced from PubChem (CID 106685121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).