5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide

C17H21N5O3 — CID 100677325

IUPAC5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide
SMILESCCOc1ncccc1C(=O)N1CCCC[C@@H]1c1cc(C(N)=O)n[nH]1
InChIInChI=1S/C17H21N5O3/c1-2-25-16-11(6-5-8-19-16)17(24)22-9-4-3-7-14(22)12-10-13(15(18)23)21-20-12/h5-6,8,10,14H,2-4,7,9H2,1H3,(H2,18,23)(H,20,21)/t14-/m1/s1
InChIKeySFGGKBXIAHNFSD-CQSZACIVSA-N
MW343.39 g/mol
LogP1.67
Rot. Bonds5

About 5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide

5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide (PubChem CID 100677325) has the molecular formula C17H21N5O3 and a molecular weight of 343.39 g/mol. Its IUPAC name is 5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide
PubChem CID100677325
Molecular FormulaC17H21N5O3
Molecular Weight343.39 g/mol
Exact Mass343.16
IUPAC Name5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide
SMILESCCOc1ncccc1C(=O)N1CCCC[C@@H]1c1cc(C(N)=O)n[nH]1
InChIInChI=1S/C17H21N5O3/c1-2-25-16-11(6-5-8-19-16)17(24)22-9-4-3-7-14(22)12-10-13(15(18)23)21-20-12/h5-6,8,10,14H,2-4,7,9H2,1H3,(H2,18,23)(H,20,21)/t14-/m1/s1
InChIKeySFGGKBXIAHNFSD-CQSZACIVSA-N
XLogP1.67
TPSA114.20 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(2R)-1-(2-methylsulfanylbenzoyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide
CID 100676612
5-[(2R)-1-[2-(trifluoromethyl)benzoyl]piperidin-2-yl]-1H-pyrazole-3-carboxamide
CID 100676203
(2-ethoxy-3-pyridinyl)-[(2R)-2-pyrazin-2-ylpyrrolidin-1-yl]methanone
CID 125022626
5-[(2R)-1-(3-chlorobenzoyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide
CID 100676115
(2-ethoxy-3-pyridinyl)-[(2S)-2-[2-(methylamino)-4-pyridinyl]pyrrolidin-1-yl]methanone
CID 125016079
(2-ethoxy-3-pyridinyl)-[(2S)-2-[2-methyl-5-(3-methyl-4-pyridinyl)pyrimidin-4-yl]piperidin-1-yl]methanone
CID 92593239
5-[(2S)-1-(5-chloro-6-oxo-1H-pyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide
CID 100677443
ethyl 1-(2-methylpyridine-3-carbonyl)piperidine-2-carboxylate
CID 21255125
(2-ethoxy-3-pyridinyl)-(3-phenylazepan-1-yl)methanone
CID 121146196
N-cyclopentyl-5-[1-(pyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide
CID 110268878
(2R)-1-[1-(2-ethoxypyridine-3-carbonyl)piperidin-4-yl]pyrrolidine-2-carboxamide
CID 95149907
(2-methoxy-3-pyridinyl)-[(2R)-2-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone
CID 129486748

Frequently Asked Questions

What is the IUPAC name of 5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide (CID 100677325) is 5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide is CCOc1ncccc1C(=O)N1CCCC[C@@H]1c1cc(C(N)=O)n[nH]1.
What is the InChIKey of 5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide?
The InChIKey is SFGGKBXIAHNFSD-CQSZACIVSA-N. The full InChI is InChI=1S/C17H21N5O3/c1-2-25-16-11(6-5-8-19-16)17(24)22-9-4-3-7-14(22)12-10-13(15(18)23)21-20-12/h5-6,8,10,14H,2-4,7,9H2,1H3,(H2,18,23)(H,20,21)/t14-/m1/s1.
What are the key properties of 5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide?
5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide has a molecular weight of 343.39 g/mol, XLogP of 1.67, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2R)-1-(2-ethoxypyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 100677325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).