2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide

C10H13N7O — CID 62248741

IUPAC2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide
SMILESCC(NC(=O)c1ccccc1NN)c1nn[nH]n1
InChIInChI=1S/C10H13N7O/c1-6(9-14-16-17-15-9)12-10(18)7-4-2-3-5-8(7)13-11/h2-6,13H,11H2,1H3,(H,12,18)(H,14,15,16,17)
InChIKeyVLWVWWJRCKLGOT-UHFFFAOYSA-N
MW247.26 g/mol
LogP-0.02
Rot. Bonds4

About 2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide

2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide (PubChem CID 62248741) has the molecular formula C10H13N7O and a molecular weight of 247.26 g/mol. Its IUPAC name is 2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide.

Molecular Properties

Compound Name2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide
PubChem CID62248741
Molecular FormulaC10H13N7O
Molecular Weight247.26 g/mol
Exact Mass247.12
IUPAC Name2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide
SMILESCC(NC(=O)c1ccccc1NN)c1nn[nH]n1
InChIInChI=1S/C10H13N7O/c1-6(9-14-16-17-15-9)12-10(18)7-4-2-3-5-8(7)13-11/h2-6,13H,11H2,1H3,(H,12,18)(H,14,15,16,17)
InChIKeyVLWVWWJRCKLGOT-UHFFFAOYSA-N
XLogP-0.02
TPSA121.61 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.26
LogP ≤ 5-0.02
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]pyridine-3-carboxamide
CID 81256281
3-amino-2-chloro-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide
CID 112575806
2-hydrazinyl-N-(1-phenylethyl)benzamide
CID 62248479
2,5-dimethyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide
CID 60911793
N-[1-(2H-tetrazol-5-yl)ethyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103120449
4-hydrazinyl-3-nitro-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide
CID 62247833
5-bromo-2-chloro-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide
CID 60912142
2-bromo-4-chloro-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide
CID 114024530
(2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide
CID 78977288
4-methoxy-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide
CID 60910753
6-(ethylamino)-N-[1-(2H-tetrazol-5-yl)ethyl]pyridazine-3-carboxamide
CID 62174936
2,5-dichloro-N-[1-(2H-tetrazol-5-yl)ethyl]pyridine-4-carboxamide
CID 114918317

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide?
The IUPAC name of 2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide (CID 62248741) is 2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide.
What is the SMILES notation for 2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide?
The canonical SMILES for 2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide is CC(NC(=O)c1ccccc1NN)c1nn[nH]n1.
What is the InChIKey of 2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide?
The InChIKey is VLWVWWJRCKLGOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N7O/c1-6(9-14-16-17-15-9)12-10(18)7-4-2-3-5-8(7)13-11/h2-6,13H,11H2,1H3,(H,12,18)(H,14,15,16,17).
What are the key properties of 2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide?
2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide has a molecular weight of 247.26 g/mol, XLogP of -0.02, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide is sourced from PubChem (CID 62248741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).