2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide

C6H9F2N5O — CID 166179016

IUPAC2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide
SMILESCC(F)(F)C(=O)NCCc1nn[nH]n1
InChIInChI=1S/C6H9F2N5O/c1-6(7,8)5(14)9-3-2-4-10-12-13-11-4/h2-3H2,1H3,(H,9,14)(H,10,11,12,13)
InChIKeyFEQZNAGXZFYORW-UHFFFAOYSA-N
MW205.17 g/mol
LogP-0.49
Rot. Bonds4

About 2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide

2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide (PubChem CID 166179016) has the molecular formula C6H9F2N5O and a molecular weight of 205.17 g/mol. Its IUPAC name is 2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide.

Molecular Properties

Compound Name2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide
PubChem CID166179016
Molecular FormulaC6H9F2N5O
Molecular Weight205.17 g/mol
Exact Mass205.08
IUPAC Name2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide
SMILESCC(F)(F)C(=O)NCCc1nn[nH]n1
InChIInChI=1S/C6H9F2N5O/c1-6(7,8)5(14)9-3-2-4-10-12-13-11-4/h2-3H2,1H3,(H,9,14)(H,10,11,12,13)
InChIKeyFEQZNAGXZFYORW-UHFFFAOYSA-N
XLogP-0.49
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.17
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,2,2-trifluoro-N-[5-(2H-tetrazol-5-yl)pentyl]acetamide
CID 15164342
N-[5-(1H-Tetrazol-5-yl)pentyl]-2,2,3,3,4,4,4-heptafluorobutanamide
CID 15164343
(2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide
CID 78977288
N-cyclopropyl-2-(2H-tetrazol-5-yl)acetamide
CID 18618243
2,2,3,3,4,4,5,5,5-nonafluoro-N-[4-(2H-tetrazol-5-yl)butyl]pentanamide
CID 15009178
3,3,3-Trifluoro-2-(mercaptomethyl)-N-[2-(1 H-tetrazol-5-yl)ethyl]propanamide
CID 19938464
N-butyl-2-(2H-tetrazol-5-yl)acetamide
CID 110496410
3,3,3-trifluoro-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide
CID 61852334
2,2,2-trifluoro-N-[1-(2H-tetrazol-5-yl)ethyl]acetamide
CID 61852902
3,3,3-trifluoro-N-(2H-tetrazol-5-ylmethyl)propanamide
CID 61854548
4,4,4-trifluoro-N-[1-(2H-tetrazol-5-yl)ethyl]butanamide
CID 65711770
4,4,4-trifluoro-N-(2H-tetrazol-5-ylmethyl)butanamide
CID 65711771

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide?
The IUPAC name of 2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide (CID 166179016) is 2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide.
What is the SMILES notation for 2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide?
The canonical SMILES for 2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide is CC(F)(F)C(=O)NCCc1nn[nH]n1.
What is the InChIKey of 2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide?
The InChIKey is FEQZNAGXZFYORW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F2N5O/c1-6(7,8)5(14)9-3-2-4-10-12-13-11-4/h2-3H2,1H3,(H,9,14)(H,10,11,12,13).
What are the key properties of 2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide?
2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide has a molecular weight of 205.17 g/mol, XLogP of -0.49, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-[2-(2H-tetrazol-5-yl)ethyl]propanamide is sourced from PubChem (CID 166179016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).