3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride

C4H9ClN6O — CID 130725338

IUPAC3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride
SMILESCl.NCCC(=O)Nc1nn[nH]n1
InChIInChI=1S/C4H8N6O.ClH/c5-2-1-3(11)6-4-7-9-10-8-4;/h1-2,5H2,(H2,6,7,8,9,10,11);1H
InChIKeyLKJUUQWCSZHZIS-UHFFFAOYSA-N
MW192.61 g/mol
LogP-1.09
Rot. Bonds3

About 3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride

3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride (PubChem CID 130725338) has the molecular formula C4H9ClN6O and a molecular weight of 192.61 g/mol. Its IUPAC name is 3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride
PubChem CID130725338
Molecular FormulaC4H9ClN6O
Molecular Weight192.61 g/mol
Exact Mass192.05
IUPAC Name3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride
SMILESCl.NCCC(=O)Nc1nn[nH]n1
InChIInChI=1S/C4H8N6O.ClH/c5-2-1-3(11)6-4-7-9-10-8-4;/h1-2,5H2,(H2,6,7,8,9,10,11);1H
InChIKeyLKJUUQWCSZHZIS-UHFFFAOYSA-N
XLogP-1.09
TPSA109.58 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.61
LogP ≤ 5-1.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride?
The IUPAC name of 3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride (CID 130725338) is 3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride?
The canonical SMILES for 3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride is Cl.NCCC(=O)Nc1nn[nH]n1.
What is the InChIKey of 3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride?
The InChIKey is LKJUUQWCSZHZIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N6O.ClH/c5-2-1-3(11)6-4-7-9-10-8-4;/h1-2,5H2,(H2,6,7,8,9,10,11);1H.
What are the key properties of 3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride?
3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride has a molecular weight of 192.61 g/mol, XLogP of -1.09, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2H-tetrazol-5-yl)propanamide;hydrochloride is sourced from PubChem (CID 130725338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).