3-amino-N-(2-methyltetrazol-5-yl)propanamide

C5H10N6O — CID 126972725

IUPAC3-amino-N-(2-methyltetrazol-5-yl)propanamide
SMILESCn1nnc(NC(=O)CCN)n1
InChIInChI=1S/C5H10N6O/c1-11-9-5(8-10-11)7-4(12)2-3-6/h2-3,6H2,1H3,(H,7,9,12)
InChIKeyKVUJFNLIVJPZTJ-UHFFFAOYSA-N
MW170.18 g/mol
LogP-1.50
Rot. Bonds3

About 3-amino-N-(2-methyltetrazol-5-yl)propanamide

3-amino-N-(2-methyltetrazol-5-yl)propanamide (PubChem CID 126972725) has the molecular formula C5H10N6O and a molecular weight of 170.18 g/mol. Its IUPAC name is 3-amino-N-(2-methyltetrazol-5-yl)propanamide.

Molecular Properties

Compound Name3-amino-N-(2-methyltetrazol-5-yl)propanamide
PubChem CID126972725
Molecular FormulaC5H10N6O
Molecular Weight170.18 g/mol
Exact Mass170.09
IUPAC Name3-amino-N-(2-methyltetrazol-5-yl)propanamide
SMILESCn1nnc(NC(=O)CCN)n1
InChIInChI=1S/C5H10N6O/c1-11-9-5(8-10-11)7-4(12)2-3-6/h2-3,6H2,1H3,(H,7,9,12)
InChIKeyKVUJFNLIVJPZTJ-UHFFFAOYSA-N
XLogP-1.50
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.18
LogP ≤ 5-1.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-methyltetrazol-5-yl)propanamide?
The IUPAC name of 3-amino-N-(2-methyltetrazol-5-yl)propanamide (CID 126972725) is 3-amino-N-(2-methyltetrazol-5-yl)propanamide.
What is the SMILES notation for 3-amino-N-(2-methyltetrazol-5-yl)propanamide?
The canonical SMILES for 3-amino-N-(2-methyltetrazol-5-yl)propanamide is Cn1nnc(NC(=O)CCN)n1.
What is the InChIKey of 3-amino-N-(2-methyltetrazol-5-yl)propanamide?
The InChIKey is KVUJFNLIVJPZTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N6O/c1-11-9-5(8-10-11)7-4(12)2-3-6/h2-3,6H2,1H3,(H,7,9,12).
What are the key properties of 3-amino-N-(2-methyltetrazol-5-yl)propanamide?
3-amino-N-(2-methyltetrazol-5-yl)propanamide has a molecular weight of 170.18 g/mol, XLogP of -1.50, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-methyltetrazol-5-yl)propanamide is sourced from PubChem (CID 126972725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).