1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide

C17H19NO3 — CID 62086836

IUPAC1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide
SMILESCOC1CCCC1NC(=O)c1ccc2ccccc2c1O
InChIInChI=1S/C17H19NO3/c1-21-15-8-4-7-14(15)18-17(20)13-10-9-11-5-2-3-6-12(11)16(13)19/h2-3,5-6,9-10,14-15,19H,4,7-8H2,1H3,(H,18,20)
InChIKeyQJNOHSVTVUTVEF-UHFFFAOYSA-N
MW285.34 g/mol
LogP2.84
Rot. Bonds3

About 1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide

1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide (PubChem CID 62086836) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide.

Molecular Properties

Compound Name1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide
PubChem CID62086836
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide
SMILESCOC1CCCC1NC(=O)c1ccc2ccccc2c1O
InChIInChI=1S/C17H19NO3/c1-21-15-8-4-7-14(15)18-17(20)13-10-9-11-5-2-3-6-12(11)16(13)19/h2-3,5-6,9-10,14-15,19H,4,7-8H2,1H3,(H,18,20)
InChIKeyQJNOHSVTVUTVEF-UHFFFAOYSA-N
XLogP2.84
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide?
The IUPAC name of 1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide (CID 62086836) is 1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide.
What is the SMILES notation for 1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide?
The canonical SMILES for 1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide is COC1CCCC1NC(=O)c1ccc2ccccc2c1O.
What is the InChIKey of 1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide?
The InChIKey is QJNOHSVTVUTVEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-21-15-8-4-7-14(15)18-17(20)13-10-9-11-5-2-3-6-12(11)16(13)19/h2-3,5-6,9-10,14-15,19H,4,7-8H2,1H3,(H,18,20).
What are the key properties of 1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide?
1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide has a molecular weight of 285.34 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide is sourced from PubChem (CID 62086836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).