4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide

C16H19NO2 — CID 140988588

IUPAC4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide
SMILESCCc1ccc2cc(CCC(O)C(N)=O)ccc2c1
InChIInChI=1S/C16H19NO2/c1-2-11-3-6-14-10-12(4-7-13(14)9-11)5-8-15(18)16(17)19/h3-4,6-7,9-10,15,18H,2,5,8H2,1H3,(H2,17,19)
InChIKeyMXVOZYQYZSNIPN-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.18
Rot. Bonds5

About 4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide

4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide (PubChem CID 140988588) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide.

Molecular Properties

Compound Name4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide
PubChem CID140988588
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide
SMILESCCc1ccc2cc(CCC(O)C(N)=O)ccc2c1
InChIInChI=1S/C16H19NO2/c1-2-11-3-6-14-10-12(4-7-13(14)9-11)5-8-15(18)16(17)19/h3-4,6-7,9-10,15,18H,2,5,8H2,1H3,(H2,17,19)
InChIKeyMXVOZYQYZSNIPN-UHFFFAOYSA-N
XLogP2.18
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide?
The IUPAC name of 4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide (CID 140988588) is 4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide.
What is the SMILES notation for 4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide?
The canonical SMILES for 4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide is CCc1ccc2cc(CCC(O)C(N)=O)ccc2c1.
What is the InChIKey of 4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide?
The InChIKey is MXVOZYQYZSNIPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-2-11-3-6-14-10-12(4-7-13(14)9-11)5-8-15(18)16(17)19/h3-4,6-7,9-10,15,18H,2,5,8H2,1H3,(H2,17,19).
What are the key properties of 4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide?
4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide has a molecular weight of 257.33 g/mol, XLogP of 2.18, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide is sourced from PubChem (CID 140988588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).