N-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide

C25H25N5O — CID 24653885

IUPACN-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide
SMILESCC(CNC(=O)C(Cc1ccccc1)n1cnnn1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H25N5O/c1-25(21-13-7-3-8-14-21,22-15-9-4-10-16-22)18-26-24(31)23(30-19-27-28-29-30)17-20-11-5-2-6-12-20/h2-16,19,23H,17-18H2,1H3,(H,26,31)
InChIKeyIEIVJZYAWPQQSY-UHFFFAOYSA-N
MW411.51 g/mol
LogP3.58
Rot. Bonds8

About N-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide

N-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide (PubChem CID 24653885) has the molecular formula C25H25N5O and a molecular weight of 411.51 g/mol. Its IUPAC name is N-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide
PubChem CID24653885
Molecular FormulaC25H25N5O
Molecular Weight411.51 g/mol
Exact Mass411.21
IUPAC NameN-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide
SMILESCC(CNC(=O)C(Cc1ccccc1)n1cnnn1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H25N5O/c1-25(21-13-7-3-8-14-21,22-15-9-4-10-16-22)18-26-24(31)23(30-19-27-28-29-30)17-20-11-5-2-6-12-20/h2-16,19,23H,17-18H2,1H3,(H,26,31)
InChIKeyIEIVJZYAWPQQSY-UHFFFAOYSA-N
XLogP3.58
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.51
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-3-phenyl-N-prop-2-ynyl-2-(tetrazol-1-yl)propanamide
CID 94393857
N-hexyl-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 51229398
(2S)-N-[2-(2-fluorophenyl)ethyl]-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 33195281
3-phenyl-N-[(4-propan-2-yloxyphenyl)methyl]-2-(tetrazol-1-yl)propanamide
CID 46447445
(2S)-N-(furan-2-ylmethyl)-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 94814887
(2R)-N-(furan-2-ylmethyl)-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 94814888
(2R)-N-benzhydryl-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 41096542
(2S)-N-[2-(4-methoxyphenyl)ethyl]-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 51054807
3-phenyl-2-(tetrazol-1-yl)-N-[2-(1,2,4-triazol-1-yl)ethyl]propanamide
CID 91791500
(2R)-N-[(3-fluorophenyl)methyl]-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 94048317
(2S)-N-[(3-methylthiophen-2-yl)methyl]-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 33264815
N-[1-(4-ethylphenyl)ethyl]-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 51231474

Frequently Asked Questions

What is the IUPAC name of N-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide?
The IUPAC name of N-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide (CID 24653885) is N-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide.
What is the SMILES notation for N-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide?
The canonical SMILES for N-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide is CC(CNC(=O)C(Cc1ccccc1)n1cnnn1)(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide?
The InChIKey is IEIVJZYAWPQQSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N5O/c1-25(21-13-7-3-8-14-21,22-15-9-4-10-16-22)18-26-24(31)23(30-19-27-28-29-30)17-20-11-5-2-6-12-20/h2-16,19,23H,17-18H2,1H3,(H,26,31).
What are the key properties of N-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide?
N-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide has a molecular weight of 411.51 g/mol, XLogP of 3.58, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-diphenylpropyl)-3-phenyl-2-(tetrazol-1-yl)propanamide is sourced from PubChem (CID 24653885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).