N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide

C14H17N5O — CID 8685045

IUPACN-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide
SMILESC[C@@H](NC(=O)Cn1nnc(-c2ccccc2)n1)C1CC1
InChIInChI=1S/C14H17N5O/c1-10(11-7-8-11)15-13(20)9-19-17-14(16-18-19)12-5-3-2-4-6-12/h2-6,10-11H,7-9H2,1H3,(H,15,20)/t10-/m1/s1
InChIKeyGJDFRGYVFCKHFO-SNVBAGLBSA-N
MW271.32 g/mol
LogP1.25
Rot. Bonds5

About N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide

N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide (PubChem CID 8685045) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide.

Molecular Properties

Compound NameN-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide
PubChem CID8685045
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC NameN-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide
SMILESC[C@@H](NC(=O)Cn1nnc(-c2ccccc2)n1)C1CC1
InChIInChI=1S/C14H17N5O/c1-10(11-7-8-11)15-13(20)9-19-17-14(16-18-19)12-5-3-2-4-6-12/h2-6,10-11H,7-9H2,1H3,(H,15,20)/t10-/m1/s1
InChIKeyGJDFRGYVFCKHFO-SNVBAGLBSA-N
XLogP1.25
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 29466684
2-[5-(4-bromophenyl)tetrazol-2-yl]-N-[(1R)-1-cyclopropylethyl]acetamide
CID 8598098
4-[2-[2-[[(1S)-1-cyclopropylethyl]amino]-2-oxoethyl]tetrazol-5-yl]benzamide
CID 8996563
N-[(1R)-1-cyclopropylethyl]-2-[5-(3-fluorophenyl)tetrazol-2-yl]acetamide
CID 41436763
N-[(1R)-1-cyclopropylethyl]-2-[5-(4-fluoro-3-methylphenyl)tetrazol-2-yl]acetamide
CID 94813253
3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]butanoic acid
CID 119221158
N-[(1R)-1-(1-adamantyl)ethyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 7335558
N-[1-(1-adamantyl)ethyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 4810008
N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 7634196
N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 7634209
N-[(1R)-1-phenylethyl]-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]acetamide
CID 7589016
N-(3-aminobutyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 119498184

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide?
The IUPAC name of N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide (CID 8685045) is N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide.
What is the SMILES notation for N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide?
The canonical SMILES for N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide is C[C@@H](NC(=O)Cn1nnc(-c2ccccc2)n1)C1CC1.
What is the InChIKey of N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide?
The InChIKey is GJDFRGYVFCKHFO-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H17N5O/c1-10(11-7-8-11)15-13(20)9-19-17-14(16-18-19)12-5-3-2-4-6-12/h2-6,10-11H,7-9H2,1H3,(H,15,20)/t10-/m1/s1.
What are the key properties of N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide?
N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide has a molecular weight of 271.32 g/mol, XLogP of 1.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide is sourced from PubChem (CID 8685045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).