N-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide

C18H19N5O — CID 953142

IUPACN-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide
SMILESCCn1nnc(NC(=O)C(C)(c2ccccc2)c2ccccc2)n1
InChIInChI=1S/C18H19N5O/c1-3-23-21-17(20-22-23)19-16(24)18(2,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13H,3H2,1-2H3,(H,19,21,24)
InChIKeyPMPZNGGXCKZDGB-UHFFFAOYSA-N
MW321.38 g/mol
LogP2.64
Rot. Bonds5

About N-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide

N-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide (PubChem CID 953142) has the molecular formula C18H19N5O and a molecular weight of 321.38 g/mol. Its IUPAC name is N-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide.

Molecular Properties

Compound NameN-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide
PubChem CID953142
Molecular FormulaC18H19N5O
Molecular Weight321.38 g/mol
Exact Mass321.16
IUPAC NameN-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide
SMILESCCn1nnc(NC(=O)C(C)(c2ccccc2)c2ccccc2)n1
InChIInChI=1S/C18H19N5O/c1-3-23-21-17(20-22-23)19-16(24)18(2,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13H,3H2,1-2H3,(H,19,21,24)
InChIKeyPMPZNGGXCKZDGB-UHFFFAOYSA-N
XLogP2.64
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide?
The IUPAC name of N-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide (CID 953142) is N-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide.
What is the SMILES notation for N-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide?
The canonical SMILES for N-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide is CCn1nnc(NC(=O)C(C)(c2ccccc2)c2ccccc2)n1.
What is the InChIKey of N-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide?
The InChIKey is PMPZNGGXCKZDGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O/c1-3-23-21-17(20-22-23)19-16(24)18(2,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13H,3H2,1-2H3,(H,19,21,24).
What are the key properties of N-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide?
N-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide has a molecular weight of 321.38 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyltetrazol-5-yl)-2,2-diphenylpropanamide is sourced from PubChem (CID 953142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).