2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide

C14H19NO3 — CID 103742421

IUPAC2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
SMILESCC(C)C1(CNC(=O)c2ccc(O)cc2O)CC1
InChIInChI=1S/C14H19NO3/c1-9(2)14(5-6-14)8-15-13(18)11-4-3-10(16)7-12(11)17/h3-4,7,9,16-17H,5-6,8H2,1-2H3,(H,15,18)
InChIKeyGZBNQQXMSOOYRS-UHFFFAOYSA-N
MW249.31 g/mol
LogP2.26
Rot. Bonds4

About 2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide

2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide (PubChem CID 103742421) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is 2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide.

Molecular Properties

Compound Name2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
PubChem CID103742421
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC Name2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
SMILESCC(C)C1(CNC(=O)c2ccc(O)cc2O)CC1
InChIInChI=1S/C14H19NO3/c1-9(2)14(5-6-14)8-15-13(18)11-4-3-10(16)7-12(11)17/h3-4,7,9,16-17H,5-6,8H2,1-2H3,(H,15,18)
InChIKeyGZBNQQXMSOOYRS-UHFFFAOYSA-N
XLogP2.26
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 52.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dihydroxy-N-[(2-methylthiolan-2-yl)methyl]benzamide
CID 103759085
2,4-dihydroxy-N-[(1-methoxycyclobutyl)methyl]benzamide
CID 103993294
N-[[1-(2-amino-2-oxoethyl)cyclopropyl]methyl]-2,4-dihydroxybenzamide
CID 155951860
N-(2-aminopropyl)-2,4-dihydroxybenzamide
CID 63733125
2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
CID 103773778
4-bromo-3-hydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
CID 103873707
2,4-dihydroxy-N-(2-methylbutyl)benzamide
CID 107722914
N-(3-bromo-2-methylpropyl)-2,4-dihydroxybenzamide
CID 107726046
2-bromo-5-methoxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
CID 113252964
2-amino-5-nitro-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
CID 102977042
N-(4-amino-2-methylbutyl)-2,4-dihydroxybenzamide
CID 107726381
2,4-dihydroxy-N-(2-hydroxy-2-methylpropyl)benzamide
CID 65110545

Frequently Asked Questions

What is the IUPAC name of 2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide?
The IUPAC name of 2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide (CID 103742421) is 2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide.
What is the SMILES notation for 2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide?
The canonical SMILES for 2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide is CC(C)C1(CNC(=O)c2ccc(O)cc2O)CC1.
What is the InChIKey of 2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide?
The InChIKey is GZBNQQXMSOOYRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3/c1-9(2)14(5-6-14)8-15-13(18)11-4-3-10(16)7-12(11)17/h3-4,7,9,16-17H,5-6,8H2,1-2H3,(H,15,18).
What are the key properties of 2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide?
2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide has a molecular weight of 249.31 g/mol, XLogP of 2.26, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide is sourced from PubChem (CID 103742421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).