7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide

C16H21N7O — CID 67411323

IUPAC7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide
SMILESNc1ccc(N2CCn3c(nnc3C(=O)NC3CCCC3)C2)nc1
InChIInChI=1S/C16H21N7O/c17-11-5-6-13(18-9-11)22-7-8-23-14(10-22)20-21-15(23)16(24)19-12-3-1-2-4-12/h5-6,9,12H,1-4,7-8,10,17H2,(H,19,24)
InChIKeyUWDNZNNOLDYCQL-UHFFFAOYSA-N
MW327.39 g/mol
LogP0.95
Rot. Bonds3

About 7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide

7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide (PubChem CID 67411323) has the molecular formula C16H21N7O and a molecular weight of 327.39 g/mol. Its IUPAC name is 7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide.

Molecular Properties

Compound Name7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide
PubChem CID67411323
Molecular FormulaC16H21N7O
Molecular Weight327.39 g/mol
Exact Mass327.18
IUPAC Name7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide
SMILESNc1ccc(N2CCn3c(nnc3C(=O)NC3CCCC3)C2)nc1
InChIInChI=1S/C16H21N7O/c17-11-5-6-13(18-9-11)22-7-8-23-14(10-22)20-21-15(23)16(24)19-12-3-1-2-4-12/h5-6,9,12H,1-4,7-8,10,17H2,(H,19,24)
InChIKeyUWDNZNNOLDYCQL-UHFFFAOYSA-N
XLogP0.95
TPSA101.96 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide with MolForge

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Related Compounds

[4-(5-amino-2-pyridinyl)piperazin-1-yl]-cyclobutylmethanone
CID 43462008
(3S)-1-(5-amino-2-pyridinyl)piperidine-3-carboxamide
CID 30115330
1-[4-(5-amino-2-pyridinyl)-1,4-diazepan-1-yl]ethanone
CID 55004594
[1-(5-carbamoyl-2-pyridinyl)piperidin-4-yl]carbamic acid
CID 69360370
N-cyclohexyl-6-piperidin-1-ylpyridazine-3-carboxamide
CID 109112450
N-cyclopentyl-4-(6-piperazin-1-yl-3-pyridinyl)benzamide
CID 126510199
6-(4-cyclopropylsulfonylpiperazin-1-yl)pyridin-3-amine
CID 64554066
N-piperidin-4-yl-6-pyrrolidin-1-ylpyridine-3-carboxamide
CID 119386740
4-amino-N-cyclohexylbenzamide;hydrochloride
CID 83814043
N-cyclopentyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridine-3-carboxamide
CID 109152244
1-[1-(5-amino-2-pyridinyl)pyrrolidin-3-yl]-3-(2-fluorophenyl)urea
CID 67293554
[1-(5-amino-2-pyridinyl)piperidin-4-yl]methanol
CID 43133155

Frequently Asked Questions

What is the IUPAC name of 7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide?
The IUPAC name of 7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide (CID 67411323) is 7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide.
What is the SMILES notation for 7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide?
The canonical SMILES for 7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide is Nc1ccc(N2CCn3c(nnc3C(=O)NC3CCCC3)C2)nc1.
What is the InChIKey of 7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide?
The InChIKey is UWDNZNNOLDYCQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N7O/c17-11-5-6-13(18-9-11)22-7-8-23-14(10-22)20-21-15(23)16(24)19-12-3-1-2-4-12/h5-6,9,12H,1-4,7-8,10,17H2,(H,19,24).
What are the key properties of 7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide?
7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide has a molecular weight of 327.39 g/mol, XLogP of 0.95, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(5-amino-2-pyridinyl)-N-cyclopentyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-3-carboxamide is sourced from PubChem (CID 67411323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).