2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide

C15H16ClNO3 — CID 106685527

IUPAC2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide
SMILESCCCOc1cc(C)ccc1NC(=O)c1ccoc1Cl
InChIInChI=1S/C15H16ClNO3/c1-3-7-19-13-9-10(2)4-5-12(13)17-15(18)11-6-8-20-14(11)16/h4-6,8-9H,3,7H2,1-2H3,(H,17,18)
InChIKeyJJRGTJSGVWOZRJ-UHFFFAOYSA-N
MW293.75 g/mol
LogP4.28
Rot. Bonds5

About 2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide

2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide (PubChem CID 106685527) has the molecular formula C15H16ClNO3 and a molecular weight of 293.75 g/mol. Its IUPAC name is 2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide
PubChem CID106685527
Molecular FormulaC15H16ClNO3
Molecular Weight293.75 g/mol
Exact Mass293.08
IUPAC Name2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide
SMILESCCCOc1cc(C)ccc1NC(=O)c1ccoc1Cl
InChIInChI=1S/C15H16ClNO3/c1-3-7-19-13-9-10(2)4-5-12(13)17-15(18)11-6-8-20-14(11)16/h4-6,8-9H,3,7H2,1-2H3,(H,17,18)
InChIKeyJJRGTJSGVWOZRJ-UHFFFAOYSA-N
XLogP4.28
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.75
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dichloro-N-(4-methyl-2-propoxyphenyl)pyridine-4-carboxamide
CID 87023490
6-chloro-N-(4-methyl-2-propoxyphenyl)pyridine-2-carboxamide
CID 62233815
methyl 2-[(2-chlorofuran-3-carbonyl)amino]-5-methylbenzoate
CID 106685894
N-(4-methyl-2-propoxyphenyl)naphthalene-1-carboxamide
CID 60534076
2-methyl-N-[4-[2-(4-methyl-2-propoxyanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-3-carboxamide
CID 55901595
2-bromo-N-(4-methyl-2-propoxyphenyl)pyridine-4-carboxamide
CID 103754686
2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide
CID 106685543
N-(2-bromo-5-methylphenyl)-2-chlorofuran-3-carboxamide
CID 106685098
2-hydroxy-5-methoxy-N-(4-methyl-2-propoxyphenyl)benzamide
CID 112846311
N-(4-methyl-2-propoxyphenyl)butanamide
CID 61061572
2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide
CID 61062170
2-ethyl-5-[(4-methyl-2-propoxyphenyl)carbamoyl]furan-3-carboxylic acid
CID 120821113

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide?
The IUPAC name of 2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide (CID 106685527) is 2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide is CCCOc1cc(C)ccc1NC(=O)c1ccoc1Cl.
What is the InChIKey of 2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide?
The InChIKey is JJRGTJSGVWOZRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO3/c1-3-7-19-13-9-10(2)4-5-12(13)17-15(18)11-6-8-20-14(11)16/h4-6,8-9H,3,7H2,1-2H3,(H,17,18).
What are the key properties of 2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide?
2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide has a molecular weight of 293.75 g/mol, XLogP of 4.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide is sourced from PubChem (CID 106685527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).