N-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide

C14H17N9O — CID 138014312

IUPACN-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide
SMILESO=C(Nc1cc2ccccn2n1)N1CCN(Cc2nn[nH]n2)CC1
InChIInChI=1S/C14H17N9O/c24-14(15-12-9-11-3-1-2-4-23(11)18-12)22-7-5-21(6-8-22)10-13-16-19-20-17-13/h1-4,9H,5-8,10H2,(H,15,18,24)(H,16,17,19,20)
InChIKeyANVNECZKCANMAQ-UHFFFAOYSA-N
MW327.35 g/mol
LogP0.20
Rot. Bonds3

About N-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide

N-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide (PubChem CID 138014312) has the molecular formula C14H17N9O and a molecular weight of 327.35 g/mol. Its IUPAC name is N-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide
PubChem CID138014312
Molecular FormulaC14H17N9O
Molecular Weight327.35 g/mol
Exact Mass327.16
IUPAC NameN-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide
SMILESO=C(Nc1cc2ccccn2n1)N1CCN(Cc2nn[nH]n2)CC1
InChIInChI=1S/C14H17N9O/c24-14(15-12-9-11-3-1-2-4-23(11)18-12)22-7-5-21(6-8-22)10-13-16-19-20-17-13/h1-4,9H,5-8,10H2,(H,15,18,24)(H,16,17,19,20)
InChIKeyANVNECZKCANMAQ-UHFFFAOYSA-N
XLogP0.20
TPSA107.34 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.35
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide?
The IUPAC name of N-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide (CID 138014312) is N-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide.
What is the SMILES notation for N-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide?
The canonical SMILES for N-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide is O=C(Nc1cc2ccccn2n1)N1CCN(Cc2nn[nH]n2)CC1.
What is the InChIKey of N-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide?
The InChIKey is ANVNECZKCANMAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N9O/c24-14(15-12-9-11-3-1-2-4-23(11)18-12)22-7-5-21(6-8-22)10-13-16-19-20-17-13/h1-4,9H,5-8,10H2,(H,15,18,24)(H,16,17,19,20).
What are the key properties of N-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide?
N-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide has a molecular weight of 327.35 g/mol, XLogP of 0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrazolo[1,5-a]pyridin-2-yl-4-(2H-tetrazol-5-ylmethyl)piperazine-1-carboxamide is sourced from PubChem (CID 138014312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).