N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide

C23H20N6O — CID 52576497

IUPACN-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide
SMILESCCn1c2ccccc2c2cc(NC(=O)Cc3ccc(-n4cnnn4)cc3)ccc21
InChIInChI=1S/C23H20N6O/c1-2-28-21-6-4-3-5-19(21)20-14-17(9-12-22(20)28)25-23(30)13-16-7-10-18(11-8-16)29-15-24-26-27-29/h3-12,14-15H,2,13H2,1H3,(H,25,30)
InChIKeySKNFGWWZCPWWMU-UHFFFAOYSA-N
MW396.45 g/mol
LogP3.97
Rot. Bonds5

About N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide

N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide (PubChem CID 52576497) has the molecular formula C23H20N6O and a molecular weight of 396.45 g/mol. Its IUPAC name is N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide
PubChem CID52576497
Molecular FormulaC23H20N6O
Molecular Weight396.45 g/mol
Exact Mass396.17
IUPAC NameN-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide
SMILESCCn1c2ccccc2c2cc(NC(=O)Cc3ccc(-n4cnnn4)cc3)ccc21
InChIInChI=1S/C23H20N6O/c1-2-28-21-6-4-3-5-19(21)20-14-17(9-12-22(20)28)25-23(30)13-16-7-10-18(11-8-16)29-15-24-26-27-29/h3-12,14-15H,2,13H2,1H3,(H,25,30)
InChIKeySKNFGWWZCPWWMU-UHFFFAOYSA-N
XLogP3.97
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.45
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[(2S)-1-[(9-ethylcarbazol-3-yl)amino]-1-oxopropan-2-yl] 4-(tetrazol-1-yl)benzoate
CID 41153030
N-(9-ethylcarbazol-3-yl)-2-(1H-indol-3-yl)acetamide
CID 2466222
2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 33001295
2-(3,4-dimethylphenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 18079837
N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 55631238
N-[4-(tetrazol-1-yl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 7930070
3-(4-chlorophenyl)-N-(9-ethylcarbazol-3-yl)propanamide
CID 100589996
N-(9-ethylcarbazol-3-yl)-3-[[2-(4-phenylphenyl)acetyl]hydrazinylidene]butanamide
CID 3107347
N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 78862634
N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 55630981
2-[carbamoyl(methyl)amino]-N-(9-ethylcarbazol-3-yl)acetamide
CID 9400428
2-(benzotriazol-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 857306

Frequently Asked Questions

What is the IUPAC name of N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide?
The IUPAC name of N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide (CID 52576497) is N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide is CCn1c2ccccc2c2cc(NC(=O)Cc3ccc(-n4cnnn4)cc3)ccc21.
What is the InChIKey of N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide?
The InChIKey is SKNFGWWZCPWWMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N6O/c1-2-28-21-6-4-3-5-19(21)20-14-17(9-12-22(20)28)25-23(30)13-16-7-10-18(11-8-16)29-15-24-26-27-29/h3-12,14-15H,2,13H2,1H3,(H,25,30).
What are the key properties of N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide?
N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide has a molecular weight of 396.45 g/mol, XLogP of 3.97, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 52576497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).