N-cyclopropyl-2-(tetrazol-1-yl)acetamide

C6H9N5O — CID 4134847

IUPACN-cyclopropyl-2-(tetrazol-1-yl)acetamide
SMILESO=C(Cn1cnnn1)NC1CC1
InChIInChI=1S/C6H9N5O/c12-6(8-5-1-2-5)3-11-4-7-9-10-11/h4-5H,1-3H2,(H,8,12)
InChIKeyQBSJALKYZVJJOK-UHFFFAOYSA-N
MW167.17 g/mol
LogP-1.05
Rot. Bonds3

About N-cyclopropyl-2-(tetrazol-1-yl)acetamide

N-cyclopropyl-2-(tetrazol-1-yl)acetamide (PubChem CID 4134847) has the molecular formula C6H9N5O and a molecular weight of 167.17 g/mol. Its IUPAC name is N-cyclopropyl-2-(tetrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(tetrazol-1-yl)acetamide
PubChem CID4134847
Molecular FormulaC6H9N5O
Molecular Weight167.17 g/mol
Exact Mass167.08
IUPAC NameN-cyclopropyl-2-(tetrazol-1-yl)acetamide
SMILESO=C(Cn1cnnn1)NC1CC1
InChIInChI=1S/C6H9N5O/c12-6(8-5-1-2-5)3-11-4-7-9-10-11/h4-5H,1-3H2,(H,8,12)
InChIKeyQBSJALKYZVJJOK-UHFFFAOYSA-N
XLogP-1.05
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 5-1.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-2-(3-nitro-1,2,4-triazol-1-yl)acetamide
CID 1519141
N-cyclopentyl-2-(tetrazol-1-yl)acetamide
CID 39891812
N-propan-2-yl-2-(1,2,4-triazol-1-yl)propanamide
CID 42947749
N-[2-(4-ethylpiperazin-1-yl)propyl]-2-(tetrazol-1-yl)acetamide
CID 45823936
N-butan-2-yl-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]acetamide
CID 47839833
N-isopropyl-2-{[1-methyl-2-(1H-1,2,4-triazol-1-yl)ethyl]amino}acetamide
CID 56714239
2-[3-(dimethylamino)pyrrolidin-1-yl]-N-[2-(1H-tetrazol-1-yl)ethyl]acetamide
CID 91841393
N-(3-amino-2,2-difluoropropyl)-2-(tetrazol-1-yl)acetamide
CID 114383532
N-(3-amino-2,2-difluoropropyl)-2-(tetrazol-1-yl)acetamide;hydrochloride
CID 120408029
N-cycloheptyl-2-(tetrazol-1-yl)acetamide
CID 2461385
1-(piperazin-1-yl)-2-(1H-1,2,3,4-tetrazol-1-yl)ethan-1-one
CID 16228151
N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide
CID 21244568

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(tetrazol-1-yl)acetamide?
The IUPAC name of N-cyclopropyl-2-(tetrazol-1-yl)acetamide (CID 4134847) is N-cyclopropyl-2-(tetrazol-1-yl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(tetrazol-1-yl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(tetrazol-1-yl)acetamide is O=C(Cn1cnnn1)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-(tetrazol-1-yl)acetamide?
The InChIKey is QBSJALKYZVJJOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N5O/c12-6(8-5-1-2-5)3-11-4-7-9-10-11/h4-5H,1-3H2,(H,8,12).
What are the key properties of N-cyclopropyl-2-(tetrazol-1-yl)acetamide?
N-cyclopropyl-2-(tetrazol-1-yl)acetamide has a molecular weight of 167.17 g/mol, XLogP of -1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(tetrazol-1-yl)acetamide is sourced from PubChem (CID 4134847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).