N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide

C14H19N5O2 — CID 103945863

IUPACN-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide
SMILESCCC(C)(CCO)NC(=O)c1ccc(-n2cnnn2)cc1
InChIInChI=1S/C14H19N5O2/c1-3-14(2,8-9-20)16-13(21)11-4-6-12(7-5-11)19-10-15-17-18-19/h4-7,10,20H,3,8-9H2,1-2H3,(H,16,21)
InChIKeyYPJLZDRVSAUHRR-UHFFFAOYSA-N
MW289.34 g/mol
LogP0.94
Rot. Bonds6

About N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide

N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide (PubChem CID 103945863) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide
PubChem CID103945863
Molecular FormulaC14H19N5O2
Molecular Weight289.34 g/mol
Exact Mass289.15
IUPAC NameN-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide
SMILESCCC(C)(CCO)NC(=O)c1ccc(-n2cnnn2)cc1
InChIInChI=1S/C14H19N5O2/c1-3-14(2,8-9-20)16-13(21)11-4-6-12(7-5-11)19-10-15-17-18-19/h4-7,10,20H,3,8-9H2,1-2H3,(H,16,21)
InChIKeyYPJLZDRVSAUHRR-UHFFFAOYSA-N
XLogP0.94
TPSA92.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide 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

N-(1-hydroxy-3-methylpentan-3-yl)-4-imidazol-1-ylbenzamide
CID 110002138
N-(1-hydroxy-3-methylpentan-3-yl)pyridine-4-carboxamide
CID 86783655
4-(4-ethylpiperazin-1-yl)-N-(1-hydroxy-3-methylpentan-3-yl)benzamide
CID 110002142
N-(2-hydroxy-2-methylpropyl)-4-(tetrazol-1-yl)benzamide
CID 65109439
4-(tetrazol-1-yl)benzohydrazide
CID 2114009
N-(1-amino-2,3-dimethylbutan-2-yl)-4-(tetrazol-1-yl)benzamide;hydrochloride
CID 119607738
N-(2-ethylbutyl)-4-(tetrazol-1-yl)benzamide
CID 115612743
2-hydroxy-2-methyl-3-[[4-(tetrazol-1-yl)benzoyl]amino]propanoic acid
CID 66172388
N-[2-(ethylamino)ethyl]-4-(tetrazol-1-yl)benzamide
CID 55101010
3,4-difluoro-N-(1-hydroxy-3-methylpentan-3-yl)benzamide
CID 113356518
4-tert-butyl-N-[2-[[4-(tetrazol-1-yl)benzoyl]amino]phenyl]benzamide
CID 31971288
N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide
CID 7465186

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide?
The IUPAC name of N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide (CID 103945863) is N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide.
What is the SMILES notation for N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide?
The canonical SMILES for N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide is CCC(C)(CCO)NC(=O)c1ccc(-n2cnnn2)cc1.
What is the InChIKey of N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide?
The InChIKey is YPJLZDRVSAUHRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O2/c1-3-14(2,8-9-20)16-13(21)11-4-6-12(7-5-11)19-10-15-17-18-19/h4-7,10,20H,3,8-9H2,1-2H3,(H,16,21).
What are the key properties of N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide?
N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide has a molecular weight of 289.34 g/mol, XLogP of 0.94, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-3-methylpentan-3-yl)-4-(tetrazol-1-yl)benzamide is sourced from PubChem (CID 103945863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).