N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide

C8H13N5O — CID 83022777

IUPACN-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide
SMILESO=C(NN1CCCCC1)c1ncn[nH]1
InChIInChI=1S/C8H13N5O/c14-8(7-9-6-10-11-7)12-13-4-2-1-3-5-13/h6H,1-5H2,(H,12,14)(H,9,10,11)
InChIKeyANXZGVAVDLVFDY-UHFFFAOYSA-N
MW195.23 g/mol
LogP-0.06
Rot. Bonds2

About N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide

N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide (PubChem CID 83022777) has the molecular formula C8H13N5O and a molecular weight of 195.23 g/mol. Its IUPAC name is N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide.

Molecular Properties

Compound NameN-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide
PubChem CID83022777
Molecular FormulaC8H13N5O
Molecular Weight195.23 g/mol
Exact Mass195.11
IUPAC NameN-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide
SMILESO=C(NN1CCCCC1)c1ncn[nH]1
InChIInChI=1S/C8H13N5O/c14-8(7-9-6-10-11-7)12-13-4-2-1-3-5-13/h6H,1-5H2,(H,12,14)(H,9,10,11)
InChIKeyANXZGVAVDLVFDY-UHFFFAOYSA-N
XLogP-0.06
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.23
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide
CID 83021412
1H-1,2,4-triazole-5-carbohydrazide
CID 2760675
1-(1H-1,2,4-triazole-5-carbonylamino)cycloheptane-1-carboxylic acid
CID 63653820
piperidin-1-yl(1H-1,2,4-triazol-5-yl)methanimine
CID 135965159
N-(1-methylpiperidin-4-yl)-1H-1,2,4-triazole-5-carboxamide
CID 67184534
N-(1H-1,2,4-triazol-5-ylmethyl)pyrrolidine-1-carboxamide
CID 78973043
N-[(1R,5R,6S,7R)-7-pyrrolidin-1-yl-2-oxabicyclo[3.2.0]heptan-6-yl]-1H-1,2,4-triazole-5-carboxamide
CID 91774100
N-[(1R,2R)-2-aminocyclohexyl]-1H-1,2,4-triazole-5-carboxamide
CID 102724932
N-[[1-(hydroxymethyl)cyclopentyl]methyl]-1H-1,2,4-triazole-5-carboxamide
CID 115363144
4-amino-N-piperidin-1-yl-1H-pyrrole-2-carboxamide
CID 83012564
N-(2,2-difluoroethyl)-1H-1,2,4-triazole-5-carboxamide
CID 115283347
N-(2-chlorophenyl)-1H-1,2,4-triazole-5-carboxamide
CID 804912

Frequently Asked Questions

What is the IUPAC name of N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide?
The IUPAC name of N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide (CID 83022777) is N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide.
What is the SMILES notation for N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide?
The canonical SMILES for N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide is O=C(NN1CCCCC1)c1ncn[nH]1.
What is the InChIKey of N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide?
The InChIKey is ANXZGVAVDLVFDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5O/c14-8(7-9-6-10-11-7)12-13-4-2-1-3-5-13/h6H,1-5H2,(H,12,14)(H,9,10,11).
What are the key properties of N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide?
N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide has a molecular weight of 195.23 g/mol, XLogP of -0.06, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-1-yl-1H-1,2,4-triazole-5-carboxamide is sourced from PubChem (CID 83022777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).