N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide

C16H19N5O — CID 29466684

IUPACN-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide
SMILESO=C(Cn1nnc(-c2ccccc2)n1)NC(C1CC1)C1CC1
InChIInChI=1S/C16H19N5O/c22-14(17-15(11-6-7-11)12-8-9-12)10-21-19-16(18-20-21)13-4-2-1-3-5-13/h1-5,11-12,15H,6-10H2,(H,17,22)
InChIKeyDWZAFWYOTFVOBJ-UHFFFAOYSA-N
MW297.36 g/mol
LogP1.64
Rot. Bonds6

About N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide

N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide (PubChem CID 29466684) has the molecular formula C16H19N5O and a molecular weight of 297.36 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide
PubChem CID29466684
Molecular FormulaC16H19N5O
Molecular Weight297.36 g/mol
Exact Mass297.16
IUPAC NameN-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide
SMILESO=C(Cn1nnc(-c2ccccc2)n1)NC(C1CC1)C1CC1
InChIInChI=1S/C16H19N5O/c22-14(17-15(11-6-7-11)12-8-9-12)10-21-19-16(18-20-21)13-4-2-1-3-5-13/h1-5,11-12,15H,6-10H2,(H,17,22)
InChIKeyDWZAFWYOTFVOBJ-UHFFFAOYSA-N
XLogP1.64
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 8685045
N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 7634196
4-[2-[2-[[(1S)-1-cyclopropylethyl]amino]-2-oxoethyl]tetrazol-5-yl]benzamide
CID 8996563
3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]butanoic acid
CID 119221158
2-[5-(4-bromophenyl)tetrazol-2-yl]-N-[(1R)-1-cyclopropylethyl]acetamide
CID 8598098
N-[(1R)-1-(1-adamantyl)ethyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 7335558
N-[(1R)-1-cyclopropylethyl]-2-[5-(3-fluorophenyl)tetrazol-2-yl]acetamide
CID 41436763
N-[1-(1-adamantyl)ethyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 4810008
2,2-diphenyl-N'-[2-(5-phenyltetrazol-2-yl)acetyl]acetohydrazide
CID 9468304
2-(5-phenyltetrazol-2-yl)acetic acid
CID 1086563
N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 7634209
N-[2-(aminomethyl)cyclopentyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 119603819

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide?
The IUPAC name of N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide (CID 29466684) is N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide.
What is the SMILES notation for N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide?
The canonical SMILES for N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide is O=C(Cn1nnc(-c2ccccc2)n1)NC(C1CC1)C1CC1.
What is the InChIKey of N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide?
The InChIKey is DWZAFWYOTFVOBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O/c22-14(17-15(11-6-7-11)12-8-9-12)10-21-19-16(18-20-21)13-4-2-1-3-5-13/h1-5,11-12,15H,6-10H2,(H,17,22).
What are the key properties of N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide?
N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide has a molecular weight of 297.36 g/mol, XLogP of 1.64, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide is sourced from PubChem (CID 29466684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).