(7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide

C13H17N5O — CID 97329392

IUPAC(7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
SMILESCCc1cc(NC(=O)[C@H]2CCn3cncc3C2)n[nH]1
InChIInChI=1S/C13H17N5O/c1-2-10-6-12(17-16-10)15-13(19)9-3-4-18-8-14-7-11(18)5-9/h6-9H,2-5H2,1H3,(H2,15,16,17,19)/t9-/m0/s1
InChIKeyPOTNKCACLMDYNM-VIFPVBQESA-N
MW259.31 g/mol
LogP1.37
Rot. Bonds3

About (7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide

(7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide (PubChem CID 97329392) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is (7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide.

Molecular Properties

Compound Name(7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
PubChem CID97329392
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name(7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
SMILESCCc1cc(NC(=O)[C@H]2CCn3cncc3C2)n[nH]1
InChIInChI=1S/C13H17N5O/c1-2-10-6-12(17-16-10)15-13(19)9-3-4-18-8-14-7-11(18)5-9/h6-9H,2-5H2,1H3,(H2,15,16,17,19)/t9-/m0/s1
InChIKeyPOTNKCACLMDYNM-VIFPVBQESA-N
XLogP1.37
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
The IUPAC name of (7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide (CID 97329392) is (7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide.
What is the SMILES notation for (7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
The canonical SMILES for (7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide is CCc1cc(NC(=O)[C@H]2CCn3cncc3C2)n[nH]1.
What is the InChIKey of (7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
The InChIKey is POTNKCACLMDYNM-VIFPVBQESA-N. The full InChI is InChI=1S/C13H17N5O/c1-2-10-6-12(17-16-10)15-13(19)9-3-4-18-8-14-7-11(18)5-9/h6-9H,2-5H2,1H3,(H2,15,16,17,19)/t9-/m0/s1.
What are the key properties of (7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
(7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7S)-N-(5-ethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide is sourced from PubChem (CID 97329392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).