N-(2-butyltetrazol-5-yl)furan-2-carboxamide

C10H13N5O2 — CID 2219054

IUPACN-(2-butyltetrazol-5-yl)furan-2-carboxamide
SMILESCCCCn1nnc(NC(=O)c2ccco2)n1
InChIInChI=1S/C10H13N5O2/c1-2-3-6-15-13-10(12-14-15)11-9(16)8-5-4-7-17-8/h4-5,7H,2-3,6H2,1H3,(H,11,13,16)
InChIKeyDQBVNHWYAMIVNR-UHFFFAOYSA-N
MW235.25 g/mol
LogP1.32
Rot. Bonds5

About N-(2-butyltetrazol-5-yl)furan-2-carboxamide

N-(2-butyltetrazol-5-yl)furan-2-carboxamide (PubChem CID 2219054) has the molecular formula C10H13N5O2 and a molecular weight of 235.25 g/mol. Its IUPAC name is N-(2-butyltetrazol-5-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-butyltetrazol-5-yl)furan-2-carboxamide
PubChem CID2219054
Molecular FormulaC10H13N5O2
Molecular Weight235.25 g/mol
Exact Mass235.11
IUPAC NameN-(2-butyltetrazol-5-yl)furan-2-carboxamide
SMILESCCCCn1nnc(NC(=O)c2ccco2)n1
InChIInChI=1S/C10H13N5O2/c1-2-3-6-15-13-10(12-14-15)11-9(16)8-5-4-7-17-8/h4-5,7H,2-3,6H2,1H3,(H,11,13,16)
InChIKeyDQBVNHWYAMIVNR-UHFFFAOYSA-N
XLogP1.32
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-butyltetrazol-5-yl)furan-2-carboxamide?
The IUPAC name of N-(2-butyltetrazol-5-yl)furan-2-carboxamide (CID 2219054) is N-(2-butyltetrazol-5-yl)furan-2-carboxamide.
What is the SMILES notation for N-(2-butyltetrazol-5-yl)furan-2-carboxamide?
The canonical SMILES for N-(2-butyltetrazol-5-yl)furan-2-carboxamide is CCCCn1nnc(NC(=O)c2ccco2)n1.
What is the InChIKey of N-(2-butyltetrazol-5-yl)furan-2-carboxamide?
The InChIKey is DQBVNHWYAMIVNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O2/c1-2-3-6-15-13-10(12-14-15)11-9(16)8-5-4-7-17-8/h4-5,7H,2-3,6H2,1H3,(H,11,13,16).
What are the key properties of N-(2-butyltetrazol-5-yl)furan-2-carboxamide?
N-(2-butyltetrazol-5-yl)furan-2-carboxamide has a molecular weight of 235.25 g/mol, XLogP of 1.32, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-butyltetrazol-5-yl)furan-2-carboxamide is sourced from PubChem (CID 2219054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).