N-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide

C19H18N6O — CID 56762296

IUPACN-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide
SMILESCc1nnnn1-c1ccccc1C(=O)NCCn1ccc2ccccc21
InChIInChI=1S/C19H18N6O/c1-14-21-22-23-25(14)18-9-5-3-7-16(18)19(26)20-11-13-24-12-10-15-6-2-4-8-17(15)24/h2-10,12H,11,13H2,1H3,(H,20,26)
InChIKeyQSJDYPOQHGNMJD-UHFFFAOYSA-N
MW346.39 g/mol
LogP2.36
Rot. Bonds5

About N-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide

N-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide (PubChem CID 56762296) has the molecular formula C19H18N6O and a molecular weight of 346.39 g/mol. Its IUPAC name is N-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide
PubChem CID56762296
Molecular FormulaC19H18N6O
Molecular Weight346.39 g/mol
Exact Mass346.15
IUPAC NameN-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide
SMILESCc1nnnn1-c1ccccc1C(=O)NCCn1ccc2ccccc21
InChIInChI=1S/C19H18N6O/c1-14-21-22-23-25(14)18-9-5-3-7-16(18)19(26)20-11-13-24-12-10-15-6-2-4-8-17(15)24/h2-10,12H,11,13H2,1H3,(H,20,26)
InChIKeyQSJDYPOQHGNMJD-UHFFFAOYSA-N
XLogP2.36
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-methoxypropyl)-2-(5-methyltetrazol-1-yl)benzamide
CID 71709929
N-(2-indol-1-ylethyl)-2-iodobenzamide
CID 3247556
4-chloro-N-(2-indol-1-ylethyl)-2-(tetrazol-1-yl)benzamide
CID 56761342
N-[2-(6-chloroindol-1-yl)ethyl]-2-(tetrazol-1-yl)benzamide
CID 56761302
N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide
CID 110732644
N-[(2R)-2-ethylhexyl]-2-(5-methyltetrazol-1-yl)benzamide
CID 95860551
N-(2-indol-1-ylethyl)-4-phenylbenzamide
CID 4251768
N-(2-indol-1-ylethyl)-3-methyl-4-oxophthalazine-1-carboxamide
CID 71705958
N-(3-indol-1-ylpropyl)-2-methyl-4-propan-2-ylpyrimidine-5-carboxamide
CID 166207086
N-[2-(4-chloroindol-1-yl)ethyl]-2-(tetrazol-1-yl)benzamide
CID 86206831
4-[(4,6-dimethylpyrimidin-2-yl)amino]-N-(2-indol-1-ylethyl)benzamide
CID 108726459
(E)-N-(2-indol-1-ylethyl)but-2-enamide
CID 108750473

Frequently Asked Questions

What is the IUPAC name of N-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide?
The IUPAC name of N-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide (CID 56762296) is N-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide.
What is the SMILES notation for N-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide?
The canonical SMILES for N-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide is Cc1nnnn1-c1ccccc1C(=O)NCCn1ccc2ccccc21.
What is the InChIKey of N-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide?
The InChIKey is QSJDYPOQHGNMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6O/c1-14-21-22-23-25(14)18-9-5-3-7-16(18)19(26)20-11-13-24-12-10-15-6-2-4-8-17(15)24/h2-10,12H,11,13H2,1H3,(H,20,26).
What are the key properties of N-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide?
N-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide has a molecular weight of 346.39 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-indol-1-ylethyl)-2-(5-methyltetrazol-1-yl)benzamide is sourced from PubChem (CID 56762296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).