N-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide

C15H18N4O2 — CID 154870549

IUPACN-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide
SMILESC[C@H](ONC(=O)C1CCc2ccnn2C1)c1ccncc1
InChIInChI=1S/C15H18N4O2/c1-11(12-4-7-16-8-5-12)21-18-15(20)13-2-3-14-6-9-17-19(14)10-13/h4-9,11,13H,2-3,10H2,1H3,(H,18,20)/t11-,13?/m0/s1
InChIKeyDFFKPVJRXVPYIL-AMGKYWFPSA-N
MW286.33 g/mol
LogP1.65
Rot. Bonds4

About N-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide

N-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide (PubChem CID 154870549) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide
PubChem CID154870549
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC NameN-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide
SMILESC[C@H](ONC(=O)C1CCc2ccnn2C1)c1ccncc1
InChIInChI=1S/C15H18N4O2/c1-11(12-4-7-16-8-5-12)21-18-15(20)13-2-3-14-6-9-17-19(14)10-13/h4-9,11,13H,2-3,10H2,1H3,(H,18,20)/t11-,13?/m0/s1
InChIKeyDFFKPVJRXVPYIL-AMGKYWFPSA-N
XLogP1.65
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-cyclopropyl-5-oxo-N-[(1S)-1-pyridin-4-ylethoxy]pyrrolidine-3-carboxamide
CID 154870500
1-(6-oxopiperidin-3-yl)-N-[(1S)-1-pyridin-4-ylethoxy]cyclobutane-1-carboxamide
CID 154871558
4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde
CID 83872460
6-ethyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 170078658
(1S,2S,3S,4S)-3-[[(1S)-1-pyridin-4-ylethyl]carbamoyl]bicyclo[2.2.1]heptane-2-carboxylic acid
CID 124718039
6-oxo-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide
CID 71652098
N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide
CID 154859849
(2S,3R)-3-[[(1S)-1-pyridin-4-ylethyl]carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid
CID 27492443
N-(1-pyridin-4-ylethyl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 18160601
methyl 2-(cyclopropylamino)-2-pyridin-4-ylacetate
CID 116857371
N-[2-(1-pyridin-4-ylethylamino)ethyl]cyclopropanecarboxamide
CID 115621333
1-pyridin-4-ylethyl adamantane-1-carboxylate
CID 23355087

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide?
The IUPAC name of N-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide (CID 154870549) is N-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide?
The canonical SMILES for N-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide is C[C@H](ONC(=O)C1CCc2ccnn2C1)c1ccncc1.
What is the InChIKey of N-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide?
The InChIKey is DFFKPVJRXVPYIL-AMGKYWFPSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-11(12-4-7-16-8-5-12)21-18-15(20)13-2-3-14-6-9-17-19(14)10-13/h4-9,11,13H,2-3,10H2,1H3,(H,18,20)/t11-,13?/m0/s1.
What are the key properties of N-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide?
N-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-pyridin-4-ylethoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carboxamide is sourced from PubChem (CID 154870549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).