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

C19H21N5O — CID 125431122

IUPACN-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide
SMILESO=C(CCn1cnnn1)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H21N5O/c25-19(12-14-24-15-21-22-23-24)20-13-11-18(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,15,18H,11-14H2,(H,20,25)
InChIKeyLCNRVIXWFURANW-UHFFFAOYSA-N
MW335.41 g/mol
LogP2.40
Rot. Bonds8

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

N-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide (PubChem CID 125431122) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is N-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide
PubChem CID125431122
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC NameN-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide
SMILESO=C(CCn1cnnn1)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H21N5O/c25-19(12-14-24-15-21-22-23-24)20-13-11-18(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,15,18H,11-14H2,(H,20,25)
InChIKeyLCNRVIXWFURANW-UHFFFAOYSA-N
XLogP2.40
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2S)-2-phenyl-2-piperidin-1-ylethyl]-3-(tetrazol-1-yl)propanamide
CID 99972818
3-amino-N-(3,3-diphenylpropyl)propanamide
CID 61260173
N-(3-amino-3-phenylpropyl)-3-(1,2,4-triazol-1-yl)propanamide
CID 80506321
N-[2-[(3R)-3-(2-methylphenyl)pyrrolidin-1-yl]ethyl]-3-(tetrazol-1-yl)propanamide
CID 125180086
N-[2-[3-(2-methylphenyl)pyrrolidin-1-yl]ethyl]-3-(tetrazol-1-yl)propanamide
CID 118791343
2-phenyl-3-[[2-(tetrazol-1-yl)acetyl]amino]propanoic acid
CID 62883661
N-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)benzamide
CID 26881046
N-[(2R)-2-(4-chlorophenyl)-2-pyrrolidin-1-ylethyl]-3-(tetrazol-1-yl)propanamide
CID 125445949
N-[(2R)-4-methyl-4-phenylpentan-2-yl]-3-(tetrazol-1-yl)propanamide
CID 125440966
N-(3,3-diphenylpropyl)-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
CID 7352411
N-(benzotriazol-1-yl)-3-(tetrazol-1-yl)propanamide
CID 9429890
N-(3,3-diphenylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 7277981

Frequently Asked Questions

What is the IUPAC name of N-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide?
The IUPAC name of N-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide (CID 125431122) is N-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide.
What is the SMILES notation for N-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide?
The canonical SMILES for N-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide is O=C(CCn1cnnn1)NCCC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide?
The InChIKey is LCNRVIXWFURANW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O/c25-19(12-14-24-15-21-22-23-24)20-13-11-18(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,15,18H,11-14H2,(H,20,25).
What are the key properties of N-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide?
N-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide has a molecular weight of 335.41 g/mol, XLogP of 2.40, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)propanamide is sourced from PubChem (CID 125431122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).