N-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide

C15H21NO3 — CID 107689256

IUPACN-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide
SMILESCC(C)CCN(C(=O)c1c(O)cccc1O)C1CC1
InChIInChI=1S/C15H21NO3/c1-10(2)8-9-16(11-6-7-11)15(19)14-12(17)4-3-5-13(14)18/h3-5,10-11,17-18H,6-9H2,1-2H3
InChIKeyVCPFKKMEFPBHOU-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.75
Rot. Bonds5

About N-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide

N-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide (PubChem CID 107689256) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide
PubChem CID107689256
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC NameN-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide
SMILESCC(C)CCN(C(=O)c1c(O)cccc1O)C1CC1
InChIInChI=1S/C15H21NO3/c1-10(2)8-9-16(11-6-7-11)15(19)14-12(17)4-3-5-13(14)18/h3-5,10-11,17-18H,6-9H2,1-2H3
InChIKeyVCPFKKMEFPBHOU-UHFFFAOYSA-N
XLogP2.75
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-hydroxy-N-(3-methylbutyl)benzamide
CID 113224066
N-cyclopropyl-3-hydroxy-4-methyl-N-(3-methylbutyl)benzamide
CID 78974536
N-cyclopropyl-N-(3-methylbutyl)furan-2-carboxamide
CID 60732998
N-cyclopropyl-N-(3-methylbutyl)thiophene-2-carboxamide
CID 60733247
6-amino-N-cyclopropyl-N-(3-methylbutyl)pyridine-2-carboxamide;hydrochloride
CID 119999003
N-cyclopropyl-3-hydroxy-4-iodo-N-(3-methylbutyl)benzamide
CID 104627610
N-cyclopropyl-2-hydroxy-5-methoxy-N-(3-methylbutyl)benzamide
CID 115281180
4-(bromomethyl)-N-cyclopropyl-N-(3-methylbutyl)benzamide
CID 102851269
4-(chloromethyl)-N-cyclopropyl-N-(3-methylbutyl)benzamide
CID 54875046
4-carbamothioyl-N-cyclopropyl-N-(3-methylbutyl)benzamide
CID 78974487
2,6-dichloro-N-cyclopropyl-N-(3-methylbutyl)pyridine-4-carboxamide
CID 60782353
5-[cyclopropyl(3-methylbutyl)carbamoyl]thiophene-2-carboxylic acid
CID 115281184

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide?
The IUPAC name of N-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide (CID 107689256) is N-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide.
What is the SMILES notation for N-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide?
The canonical SMILES for N-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide is CC(C)CCN(C(=O)c1c(O)cccc1O)C1CC1.
What is the InChIKey of N-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide?
The InChIKey is VCPFKKMEFPBHOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-10(2)8-9-16(11-6-7-11)15(19)14-12(17)4-3-5-13(14)18/h3-5,10-11,17-18H,6-9H2,1-2H3.
What are the key properties of N-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide?
N-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide has a molecular weight of 263.34 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2,6-dihydroxy-N-(3-methylbutyl)benzamide is sourced from PubChem (CID 107689256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).