5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide

C13H16ClNO2 — CID 115591206

IUPAC5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide
SMILESCC(CNC(=O)c1cc(Cl)ccc1O)C1CC1
InChIInChI=1S/C13H16ClNO2/c1-8(9-2-3-9)7-15-13(17)11-6-10(14)4-5-12(11)16/h4-6,8-9,16H,2-3,7H2,1H3,(H,15,17)
InChIKeyPWPBCHBCYMEXQU-UHFFFAOYSA-N
MW253.73 g/mol
LogP2.82
Rot. Bonds4

About 5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide

5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide (PubChem CID 115591206) has the molecular formula C13H16ClNO2 and a molecular weight of 253.73 g/mol. Its IUPAC name is 5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide.

Molecular Properties

Compound Name5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide
PubChem CID115591206
Molecular FormulaC13H16ClNO2
Molecular Weight253.73 g/mol
Exact Mass253.09
IUPAC Name5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide
SMILESCC(CNC(=O)c1cc(Cl)ccc1O)C1CC1
InChIInChI=1S/C13H16ClNO2/c1-8(9-2-3-9)7-15-13(17)11-6-10(14)4-5-12(11)16/h4-6,8-9,16H,2-3,7H2,1H3,(H,15,17)
InChIKeyPWPBCHBCYMEXQU-UHFFFAOYSA-N
XLogP2.82
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.73
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-(1-cyclopropylethyl)-2-hydroxybenzamide
CID 43401499
N-(2-cyclopropylpropyl)-3-hydroxynaphthalene-2-carboxamide
CID 115591184
5-chloro-N-(2-ethylbutyl)-2-hydroxybenzamide
CID 115613546
5-chloro-2-hydroxy-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzamide
CID 47308839
5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide
CID 49167744
5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 43402430
N-(2-cyclopropylpropyl)-2-hydroxy-3-methylbenzamide
CID 115591208
5-chloro-N-(1-cyclopropylethyl)-2-hydroxy-N-methylbenzamide
CID 43420549
N-(2,2-dicyclopropylethyl)-2,5-dihydroxybenzamide
CID 107723246
2-bromo-5-chloro-N-(2,2-dicyclopropylethyl)benzamide
CID 103709264
5-chloro-N-(2-ethylhexyl)-2-hydroxybenzamide
CID 14692803
4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide
CID 114296442

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide?
The IUPAC name of 5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide (CID 115591206) is 5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide.
What is the SMILES notation for 5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide?
The canonical SMILES for 5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide is CC(CNC(=O)c1cc(Cl)ccc1O)C1CC1.
What is the InChIKey of 5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide?
The InChIKey is PWPBCHBCYMEXQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClNO2/c1-8(9-2-3-9)7-15-13(17)11-6-10(14)4-5-12(11)16/h4-6,8-9,16H,2-3,7H2,1H3,(H,15,17).
What are the key properties of 5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide?
5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide has a molecular weight of 253.73 g/mol, XLogP of 2.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide is sourced from PubChem (CID 115591206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).