3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide

C11H11Cl2N5O2 — CID 925625

IUPAC3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide
SMILESCCn1nnnc1NC(=O)c1cc(Cl)c(OC)c(Cl)c1
InChIInChI=1S/C11H11Cl2N5O2/c1-3-18-11(15-16-17-18)14-10(19)6-4-7(12)9(20-2)8(13)5-6/h4-5H,3H2,1-2H3,(H,14,15,17,19)
InChIKeyITGZVOWZHOJSRF-UHFFFAOYSA-N
MW316.15 g/mol
LogP2.26
Rot. Bonds4

About 3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide

3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide (PubChem CID 925625) has the molecular formula C11H11Cl2N5O2 and a molecular weight of 316.15 g/mol. Its IUPAC name is 3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide.

Molecular Properties

Compound Name3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide
PubChem CID925625
Molecular FormulaC11H11Cl2N5O2
Molecular Weight316.15 g/mol
Exact Mass315.03
IUPAC Name3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide
SMILESCCn1nnnc1NC(=O)c1cc(Cl)c(OC)c(Cl)c1
InChIInChI=1S/C11H11Cl2N5O2/c1-3-18-11(15-16-17-18)14-10(19)6-4-7(12)9(20-2)8(13)5-6/h4-5H,3H2,1-2H3,(H,14,15,17,19)
InChIKeyITGZVOWZHOJSRF-UHFFFAOYSA-N
XLogP2.26
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.15
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide 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

3-chloro-4-ethoxy-N-(2-propyl-2H-tetrazol-5-yl)benzamide
CID 2194000
3,5-dichloro-N-(2-ethyl-2H-tetrazol-5-yl)-4-methoxybenzamide
CID 654817
3,5-dichloro-4-methoxy-N-(2-methyltetrazol-5-yl)benzamide
CID 932392
3-chloro-4-methoxy-N-(2-methyl-2H-tetrazol-5-yl)benzamide
CID 936538
3,5-dichloro-2-methoxy-N-(2-methyl-2H-tetrazol-5-yl)benzamide
CID 3155237
3,5-dichloro-4-methoxy-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]benzamide
CID 36580214
3-chloro-4-ethoxy-N-(1-propyl-1H-tetrazol-5-yl)benzamide
CID 713646
3-chloro-4-methoxy-N-(2-propyl-2H-tetrazol-5-yl)benzamide
CID 936159
3,5-dichloro-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide
CID 1265676
3,5-dichloro-4-methoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
CID 2206200
N-(2-allyl-2H-tetraazol-5-yl)-3-chloro-4-ethoxybenzamide
CID 17177278
3,5-dichloro-4-methoxy-N-(1H-1,2,4-triazol-5-yl)benzamide
CID 30865284

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide?
The IUPAC name of 3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide (CID 925625) is 3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide.
What is the SMILES notation for 3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide?
The canonical SMILES for 3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide is CCn1nnnc1NC(=O)c1cc(Cl)c(OC)c(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide?
The InChIKey is ITGZVOWZHOJSRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Cl2N5O2/c1-3-18-11(15-16-17-18)14-10(19)6-4-7(12)9(20-2)8(13)5-6/h4-5H,3H2,1-2H3,(H,14,15,17,19).
What are the key properties of 3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide?
3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide has a molecular weight of 316.15 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-(1-ethyltetrazol-5-yl)-4-methoxybenzamide is sourced from PubChem (CID 925625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).