N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide

C17H15NO3 — CID 95986596

IUPACN-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide
SMILESO=C(NC[C@@H](O)c1ccoc1)c1cccc2ccccc12
InChIInChI=1S/C17H15NO3/c19-16(13-8-9-21-11-13)10-18-17(20)15-7-3-5-12-4-1-2-6-14(12)15/h1-9,11,16,19H,10H2,(H,18,20)/t16-/m1/s1
InChIKeyFHUQLHLXUNVJHS-MRXNPFEDSA-N
MW281.31 g/mol
LogP2.90
Rot. Bonds4

About N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide

N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide (PubChem CID 95986596) has the molecular formula C17H15NO3 and a molecular weight of 281.31 g/mol. Its IUPAC name is N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide
PubChem CID95986596
Molecular FormulaC17H15NO3
Molecular Weight281.31 g/mol
Exact Mass281.11
IUPAC NameN-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide
SMILESO=C(NC[C@@H](O)c1ccoc1)c1cccc2ccccc12
InChIInChI=1S/C17H15NO3/c19-16(13-8-9-21-11-13)10-18-17(20)15-7-3-5-12-4-1-2-6-14(12)15/h1-9,11,16,19H,10H2,(H,18,20)/t16-/m1/s1
InChIKeyFHUQLHLXUNVJHS-MRXNPFEDSA-N
XLogP2.90
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(furan-3-yl)-2-hydroxyethyl]-4-phenylbenzamide
CID 71798320
2-chloro-6-fluoro-N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]benzamide
CID 95986600
2-hydroxy-3-(naphthalene-1-carbonylamino)propanoic acid
CID 66165230
1-benzhydryl-3-[2-(furan-3-yl)-2-hydroxyethyl]urea
CID 71798424
N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]-2-(4-phenylphenyl)acetamide
CID 95986654
N-[(2R)-2-(furan-3-yl)-2-hydroxyethyl]-2-(4-phenylphenyl)acetamide
CID 95986653
N-[(3S)-3-hydroxy-3-phenylpropyl]naphthalene-1-carboxamide
CID 97038566
N-[(2R)-2-(furan-3-yl)-2-hydroxyethyl]-2-naphthalen-2-yloxyacetamide
CID 95986651
2-benzylsulfanyl-N-[(2R)-2-(furan-3-yl)-2-hydroxyethyl]acetamide
CID 95986621
5-chloro-N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]thiophene-2-carboxamide
CID 95986574
N-[3-(furan-3-yl)-3-hydroxypropyl]-2-methylsulfanylbenzamide
CID 71804418
N-(2-hydroxy-2-naphthalen-2-ylethyl)quinoline-5-carboxamide
CID 111112184

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide?
The IUPAC name of N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide (CID 95986596) is N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide is O=C(NC[C@@H](O)c1ccoc1)c1cccc2ccccc12.
What is the InChIKey of N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide?
The InChIKey is FHUQLHLXUNVJHS-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H15NO3/c19-16(13-8-9-21-11-13)10-18-17(20)15-7-3-5-12-4-1-2-6-14(12)15/h1-9,11,16,19H,10H2,(H,18,20)/t16-/m1/s1.
What are the key properties of N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide?
N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide has a molecular weight of 281.31 g/mol, XLogP of 2.90, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]naphthalene-1-carboxamide is sourced from PubChem (CID 95986596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).