N-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide

C14H15NO3 — CID 43508359

IUPACN-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(C(C)O)cc2)o1
InChIInChI=1S/C14H15NO3/c1-9-3-8-13(18-9)14(17)15-12-6-4-11(5-7-12)10(2)16/h3-8,10,16H,1-2H3,(H,15,17)
InChIKeyHLVCQWDVCQMIMT-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.89
Rot. Bonds3

About N-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide

N-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide (PubChem CID 43508359) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is N-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide
PubChem CID43508359
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC NameN-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(C(C)O)cc2)o1
InChIInChI=1S/C14H15NO3/c1-9-3-8-13(18-9)14(17)15-12-6-4-11(5-7-12)10(2)16/h3-8,10,16H,1-2H3,(H,15,17)
InChIKeyHLVCQWDVCQMIMT-UHFFFAOYSA-N
XLogP2.89
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-N-[4-(methylcarbamoylamino)phenyl]furan-2-carboxamide
CID 52555638
5-methyl-N-pyridin-4-ylfuran-2-carboxamide
CID 897103
N-[4-(2,3-dihydroxypropylamino)phenyl]-5-methylfuran-2-carboxamide
CID 168597625
1-[4-(1-hydroxyethyl)phenyl]-3-[1-(5-methylfuran-2-yl)ethyl]urea
CID 61478923
N-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide
CID 844275
N-[4-(dimethylcarbamoyl)phenyl]-5-methylfuran-2-carboxamide
CID 17394257
N-[4-[acetyl(methyl)amino]phenyl]-5-methylfuran-2-carboxamide
CID 17173460
4-ethyl-N-[4-[(1S)-1-hydroxyethyl]phenyl]benzamide
CID 93040826
5-methyl-N-[4-(propylaminomethyl)phenyl]furan-2-carboxamide
CID 106910296
N-[4-(2,2-dicyanoethenylamino)phenyl]-5-methylfuran-2-carboxamide
CID 168542050
N-[4-(1-hydroxyethyl)phenyl]-2-methylbenzamide
CID 43417161
N-(6-bromo-3-pyridinyl)-5-methylfuran-2-carboxamide
CID 103789352

Frequently Asked Questions

What is the IUPAC name of N-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide?
The IUPAC name of N-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide (CID 43508359) is N-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide.
What is the SMILES notation for N-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide?
The canonical SMILES for N-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide is Cc1ccc(C(=O)Nc2ccc(C(C)O)cc2)o1.
What is the InChIKey of N-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide?
The InChIKey is HLVCQWDVCQMIMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c1-9-3-8-13(18-9)14(17)15-12-6-4-11(5-7-12)10(2)16/h3-8,10,16H,1-2H3,(H,15,17).
What are the key properties of N-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide?
N-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide has a molecular weight of 245.28 g/mol, XLogP of 2.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1-hydroxyethyl)phenyl]-5-methylfuran-2-carboxamide is sourced from PubChem (CID 43508359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).