5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide

C14H15NO3 — CID 126453687

IUPAC5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide
SMILESCO[C@H](C)c1cccc(-c2ccc(C(N)=O)o2)c1
InChIInChI=1S/C14H15NO3/c1-9(17-2)10-4-3-5-11(8-10)12-6-7-13(18-12)14(15)16/h3-9H,1-2H3,(H2,15,16)/t9-/m1/s1
InChIKeyCTDGBRQQYCMFNQ-SECBINFHSA-N
MW245.28 g/mol
LogP2.75
Rot. Bonds4

About 5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide

5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide (PubChem CID 126453687) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is 5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide
PubChem CID126453687
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide
SMILESCO[C@H](C)c1cccc(-c2ccc(C(N)=O)o2)c1
InChIInChI=1S/C14H15NO3/c1-9(17-2)10-4-3-5-11(8-10)12-6-7-13(18-12)14(15)16/h3-9H,1-2H3,(H2,15,16)/t9-/m1/s1
InChIKeyCTDGBRQQYCMFNQ-SECBINFHSA-N
XLogP2.75
TPSA65.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-5-[3-[(1S)-1-methoxyethyl]phenyl]furan-2-carboxamide
CID 126433393
2-fluoro-5-[3-[(1S)-1-methoxyethyl]phenyl]benzamide
CID 126447046
5-(3-methylphenyl)-N-propan-2-ylfuran-2-carboxamide
CID 151471229
2-[3-[3-[(1R)-1-methoxyethyl]phenyl]phenyl]-5-methyl-1,3,4-oxadiazole
CID 97437656
N-[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]-5-(3-methoxyphenyl)furan-2-carboxamide
CID 134710433
5-[3-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide
CID 72884179
1-[5-(3-aminophenyl)furan-2-yl]ethanone
CID 165461195
3-[3-[(1S)-1-methoxyethyl]phenyl]-6-propan-2-ylpyridazine
CID 126446276
3-amino-2-[3-(1-methoxyethyl)phenyl]propanoic acid
CID 117116164
4-methoxy-3-methyl-3-[[5-(3-propan-2-ylphenyl)furan-2-carbonyl]amino]butanoic acid
CID 120532205
2-[3-(1-methoxyethyl)phenyl]-6-methylpyrimidine-4-carboxylic acid
CID 122556535
2-[3-[(1R)-1-methoxyethyl]phenyl]-6-methylpyrimidine-4-carboxylic acid
CID 125435471

Frequently Asked Questions

What is the IUPAC name of 5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide?
The IUPAC name of 5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide (CID 126453687) is 5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for 5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide?
The canonical SMILES for 5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide is CO[C@H](C)c1cccc(-c2ccc(C(N)=O)o2)c1.
What is the InChIKey of 5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide?
The InChIKey is CTDGBRQQYCMFNQ-SECBINFHSA-N. The full InChI is InChI=1S/C14H15NO3/c1-9(17-2)10-4-3-5-11(8-10)12-6-7-13(18-12)14(15)16/h3-9H,1-2H3,(H2,15,16)/t9-/m1/s1.
What are the key properties of 5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide?
5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide has a molecular weight of 245.28 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[(1R)-1-methoxyethyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 126453687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).