N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide

C15H17NO2 — CID 639967

IUPACN-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide
SMILESCC(C)(CO)NC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C15H17NO2/c1-15(2,10-17)16-14(18)13-8-7-11-5-3-4-6-12(11)9-13/h3-9,17H,10H2,1-2H3,(H,16,18)
InChIKeyUPWOCWNNHCIXJH-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.34
Rot. Bonds3

About N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide

N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide (PubChem CID 639967) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide
PubChem CID639967
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC NameN-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide
SMILESCC(C)(CO)NC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C15H17NO2/c1-15(2,10-17)16-14(18)13-8-7-11-5-3-4-6-12(11)9-13/h3-9,17H,10H2,1-2H3,(H,16,18)
InChIKeyUPWOCWNNHCIXJH-UHFFFAOYSA-N
XLogP2.34
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)naphthalene-2-carboxamide;hydrochloride
CID 119524758
3-methyl-3-(naphthalene-2-carbonylamino)butanoic acid
CID 64672120
4-methyl-4-(naphthalene-2-carbonylamino)pentanoic acid
CID 62041314
N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)naphthalene-2-carboxamide
CID 110003171
3-amino-N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide
CID 61209365
N-(1-amino-2,3-dimethylbutan-2-yl)naphthalene-2-carboxamide
CID 81486115
3-amino-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
CID 43498520
4-hydroxy-N-(1-hydroxy-2-methylpropan-2-yl)-3-methylbenzamide
CID 103957694
ethane;naphthalene-2-carbohydrazide
CID 91601372
3,5-dihydroxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
CID 103944768
N-(1-hydroxy-2-methylpropan-2-yl)-3-(2-hydroxypropan-2-yl)benzamide
CID 110486078
N-[2-ethyl-2-(hydroxymethyl)butyl]naphthalene-2-carboxamide
CID 103843738

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide?
The IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide (CID 639967) is N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide.
What is the SMILES notation for N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide?
The canonical SMILES for N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide is CC(C)(CO)NC(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide?
The InChIKey is UPWOCWNNHCIXJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-15(2,10-17)16-14(18)13-8-7-11-5-3-4-6-12(11)9-13/h3-9,17H,10H2,1-2H3,(H,16,18).
What are the key properties of N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide?
N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide has a molecular weight of 243.31 g/mol, XLogP of 2.34, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide is sourced from PubChem (CID 639967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).