N-(2-ethoxyphenyl)-2H-chromene-3-carboxamide

C18H17NO3 — CID 7464979

IUPACN-(2-ethoxyphenyl)-2H-chromene-3-carboxamide
SMILESCCOc1ccccc1NC(=O)C1=Cc2ccccc2OC1
InChIInChI=1S/C18H17NO3/c1-2-21-17-10-6-4-8-15(17)19-18(20)14-11-13-7-3-5-9-16(13)22-12-14/h3-11H,2,12H2,1H3,(H,19,20)
InChIKeyPJEIMHFSKQMORO-UHFFFAOYSA-N
MW295.34 g/mol
LogP3.50
Rot. Bonds4

About N-(2-ethoxyphenyl)-2H-chromene-3-carboxamide

N-(2-ethoxyphenyl)-2H-chromene-3-carboxamide (PubChem CID 7464979) has the molecular formula C18H17NO3 and a molecular weight of 295.34 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2H-chromene-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2H-chromene-3-carboxamide
PubChem CID7464979
Molecular FormulaC18H17NO3
Molecular Weight295.34 g/mol
Exact Mass295.12
IUPAC NameN-(2-ethoxyphenyl)-2H-chromene-3-carboxamide
SMILESCCOc1ccccc1NC(=O)C1=Cc2ccccc2OC1
InChIInChI=1S/C18H17NO3/c1-2-21-17-10-6-4-8-15(17)19-18(20)14-11-13-7-3-5-9-16(13)22-12-14/h3-11H,2,12H2,1H3,(H,19,20)
InChIKeyPJEIMHFSKQMORO-UHFFFAOYSA-N
XLogP3.50
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-2H-chromene-3-carboxamide
CID 7464960
N-(2,3-dimethylphenyl)-2H-chromene-3-carboxamide
CID 9042933
N-(5-chloro-2-methylphenyl)-2H-chromene-3-carboxamide
CID 7465015
N-[2-(prop-2-enylcarbamoyl)phenyl]-2H-chromene-3-carboxamide
CID 18090143
N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-8-ethoxy-2H-chromene-3-carboxamide
CID 55712547
N-(2-ethoxyphenyl)-2-iodobenzamide
CID 996130
6-chloro-N-(2-ethylphenyl)-2H-chromene-3-carboxamide
CID 16652197
N-(3-methylphenyl)-2H-chromene-3-carboxamide
CID 7464936
[(2R)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
CID 8746503
N-(3,5-dimethoxyphenyl)-6-ethoxy-2H-chromene-3-carboxamide
CID 46488602
4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide
CID 30843274
N-[2-(ethylaminomethyl)phenyl]-8-methoxy-2H-chromene-3-carboxamide
CID 119438960

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2H-chromene-3-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-2H-chromene-3-carboxamide (CID 7464979) is N-(2-ethoxyphenyl)-2H-chromene-3-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2H-chromene-3-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2H-chromene-3-carboxamide is CCOc1ccccc1NC(=O)C1=Cc2ccccc2OC1.
What is the InChIKey of N-(2-ethoxyphenyl)-2H-chromene-3-carboxamide?
The InChIKey is PJEIMHFSKQMORO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO3/c1-2-21-17-10-6-4-8-15(17)19-18(20)14-11-13-7-3-5-9-16(13)22-12-14/h3-11H,2,12H2,1H3,(H,19,20).
What are the key properties of N-(2-ethoxyphenyl)-2H-chromene-3-carboxamide?
N-(2-ethoxyphenyl)-2H-chromene-3-carboxamide has a molecular weight of 295.34 g/mol, XLogP of 3.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2H-chromene-3-carboxamide is sourced from PubChem (CID 7464979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).