1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide

C17H20N2O2 — CID 63622131

IUPAC1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide
SMILESO=C(NCCC1CCNC1)c1ccc2ccccc2c1O
InChIInChI=1S/C17H20N2O2/c20-16-14-4-2-1-3-13(14)5-6-15(16)17(21)19-10-8-12-7-9-18-11-12/h1-6,12,18,20H,7-11H2,(H,19,21)
InChIKeyJXNAFFRNQGQSKL-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.27
Rot. Bonds4

About 1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide

1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide (PubChem CID 63622131) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide.

Molecular Properties

Compound Name1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide
PubChem CID63622131
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide
SMILESO=C(NCCC1CCNC1)c1ccc2ccccc2c1O
InChIInChI=1S/C17H20N2O2/c20-16-14-4-2-1-3-13(14)5-6-15(16)17(21)19-10-8-12-7-9-18-11-12/h1-6,12,18,20H,7-11H2,(H,19,21)
InChIKeyJXNAFFRNQGQSKL-UHFFFAOYSA-N
XLogP2.27
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclopentylethyl)-1-hydroxynaphthalene-2-carboxamide
CID 63524506
N-(2-pyrrolidin-3-ylethyl)quinoline-4-carboxamide
CID 81478211
2,6-dimethyl-N-(2-pyrrolidin-3-ylethyl)pyridine-3-carboxamide;dihydrochloride
CID 119537084
2,4-difluoro-N-(2-pyrrolidin-3-ylethyl)benzamide;hydrochloride
CID 119536472
2,3,4-trimethoxy-N-(2-pyrrolidin-3-ylethyl)benzamide;hydrochloride
CID 119535878
2-iodo-3-methyl-N-(2-pyrrolidin-3-ylethyl)benzamide;hydrochloride
CID 119534818
2,5-difluoro-N-(2-pyrrolidin-3-ylethyl)benzamide;hydrochloride
CID 119534638
2-[(4-methoxybenzoyl)amino]-N-(2-pyrrolidin-3-ylethyl)benzamide;hydrochloride
CID 119537859
2-methyl-N-(2-pyrrolidin-3-ylethyl)-1H-pyrrole-3-carboxamide
CID 119537626
3-chloro-2-methyl-N-(2-pyrrolidin-3-ylethyl)benzamide
CID 107098145
4-bromo-2-chloro-N-(2-pyrrolidin-3-ylethyl)benzamide
CID 63630406
2-naphthalen-2-yl-N-(2-pyrrolidin-3-ylethyl)propanamide;hydrochloride
CID 119537609

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide?
The IUPAC name of 1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide (CID 63622131) is 1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide.
What is the SMILES notation for 1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide?
The canonical SMILES for 1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide is O=C(NCCC1CCNC1)c1ccc2ccccc2c1O.
What is the InChIKey of 1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide?
The InChIKey is JXNAFFRNQGQSKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c20-16-14-4-2-1-3-13(14)5-6-15(16)17(21)19-10-8-12-7-9-18-11-12/h1-6,12,18,20H,7-11H2,(H,19,21).
What are the key properties of 1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide?
1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.27, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-(2-pyrrolidin-3-ylethyl)naphthalene-2-carboxamide is sourced from PubChem (CID 63622131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).