N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide

C15H23NO3 — CID 61245771

IUPACN-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide
SMILESCOc1ccc(C)cc1C(=O)NC(CO)CC(C)C
InChIInChI=1S/C15H23NO3/c1-10(2)7-12(9-17)16-15(18)13-8-11(3)5-6-14(13)19-4/h5-6,8,10,12,17H,7,9H2,1-4H3,(H,16,18)
InChIKeySUMREDATQRCBPA-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.14
Rot. Bonds6

About N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide

N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide (PubChem CID 61245771) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide.

Molecular Properties

Compound NameN-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide
PubChem CID61245771
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC NameN-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide
SMILESCOc1ccc(C)cc1C(=O)NC(CO)CC(C)C
InChIInChI=1S/C15H23NO3/c1-10(2)7-12(9-17)16-15(18)13-8-11(3)5-6-14(13)19-4/h5-6,8,10,12,17H,7,9H2,1-4H3,(H,16,18)
InChIKeySUMREDATQRCBPA-UHFFFAOYSA-N
XLogP2.14
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxybenzamide
CID 113344752
N-(1-hydroxypentan-3-yl)-2-methoxy-5-methylbenzamide
CID 115767323
N-(1-hydroxy-4-methylpentan-2-yl)-3,5-dimethoxy-4-methylbenzamide
CID 61246474
N-(4-aminopentan-2-yl)-2-methoxy-5-methylbenzamide
CID 113376825
N-(1-chloro-4-methylpentan-2-yl)-2,5-dimethoxybenzamide
CID 114300830
(2R)-2-[(2-methoxy-5-methylbenzoyl)amino]-3-methylbutanoic acid
CID 79010669
N-(1-bromo-4-methylpentan-2-yl)-2,5-dimethylbenzamide
CID 113274960
N-(1-cyanobutan-2-yl)-2-methoxy-5-methylbenzamide
CID 62647253
2-amino-N-(1-hydroxy-4-methylpentan-2-yl)-4-methoxybenzamide
CID 115412958
5-chloro-N-(1-hydroxybutan-2-yl)-2-methoxybenzamide
CID 43390352
2-methoxy-5-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 9301929
N-(1-chloro-4-methylpentan-2-yl)-2-methoxybenzamide
CID 113272537

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide?
The IUPAC name of N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide (CID 61245771) is N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide.
What is the SMILES notation for N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide?
The canonical SMILES for N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide is COc1ccc(C)cc1C(=O)NC(CO)CC(C)C.
What is the InChIKey of N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide?
The InChIKey is SUMREDATQRCBPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-10(2)7-12(9-17)16-15(18)13-8-11(3)5-6-14(13)19-4/h5-6,8,10,12,17H,7,9H2,1-4H3,(H,16,18).
What are the key properties of N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide?
N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide has a molecular weight of 265.35 g/mol, XLogP of 2.14, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-4-methylpentan-2-yl)-2-methoxy-5-methylbenzamide is sourced from PubChem (CID 61245771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).