2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide

C19H30N4O3 — CID 92631951

IUPAC2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide
SMILESCOCC(=O)NCC[C@H]1CCCCN1C(=O)c1c2c(nn1C)CCCC2
InChIInChI=1S/C19H30N4O3/c1-22-18(15-8-3-4-9-16(15)21-22)19(25)23-12-6-5-7-14(23)10-11-20-17(24)13-26-2/h14H,3-13H2,1-2H3,(H,20,24)/t14-/m1/s1
InChIKeyJNAIZMCSNIHYGN-CQSZACIVSA-N
MW362.47 g/mol
LogP1.45
Rot. Bonds6

About 2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide

2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide (PubChem CID 92631951) has the molecular formula C19H30N4O3 and a molecular weight of 362.47 g/mol. Its IUPAC name is 2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide
PubChem CID92631951
Molecular FormulaC19H30N4O3
Molecular Weight362.47 g/mol
Exact Mass362.23
IUPAC Name2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide
SMILESCOCC(=O)NCC[C@H]1CCCCN1C(=O)c1c2c(nn1C)CCCC2
InChIInChI=1S/C19H30N4O3/c1-22-18(15-8-3-4-9-16(15)21-22)19(25)23-12-6-5-7-14(23)10-11-20-17(24)13-26-2/h14H,3-13H2,1-2H3,(H,20,24)/t14-/m1/s1
InChIKeyJNAIZMCSNIHYGN-CQSZACIVSA-N
XLogP1.45
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide with MolForge

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Related Compounds

2-methoxy-1-[4-[1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-4-yl]piperidin-1-yl]ethanone
CID 154818159
2-methoxy-N-[2-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-2-yl]ethyl]acetamide
CID 92631947
1-[2-(2-hydroxyethyl)piperidin-1-yl]-2-(5,6,7,8-tetrahydroquinolin-4-yloxy)ethanone
CID 90640723
N-[2-[1-(2-methoxyacetyl)piperidin-2-yl]ethyl]methanesulfonamide
CID 61215593
[(1R,2S,9R)-7,11-diazatricyclo[7.3.1.02,7]tridecan-11-yl]-(2-methyl-4,5,6,7-tetrahydroindazol-3-yl)methanone
CID 154569986
N-[[(2R,4S,5S)-5-(3-cyclopentyl-1-methylpyrazol-5-yl)-1-azabicyclo[2.2.2]octan-2-yl]methyl]-2-methoxyacetamide
CID 162842978
methyl 2-(2-hydrazinylethyl)piperidine-1-carboxylate
CID 84670171
2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide
CID 108505067
methyl 2-(2-hydrazinylethyl)azepane-1-carboxylate
CID 84681171
methyl 2-[1-(2-methyltriazole-4-carbonyl)piperidin-2-yl]acetate
CID 114284658
2-hydroxy-1-[2-(2-methoxyethyl)piperidin-1-yl]ethanone
CID 77474029
N-[2-[4-(hydroxycarbamoyl)phenyl]ethyl]-2-methyl-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 87392810

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide?
The IUPAC name of 2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide (CID 92631951) is 2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide?
The canonical SMILES for 2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide is COCC(=O)NCC[C@H]1CCCCN1C(=O)c1c2c(nn1C)CCCC2.
What is the InChIKey of 2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide?
The InChIKey is JNAIZMCSNIHYGN-CQSZACIVSA-N. The full InChI is InChI=1S/C19H30N4O3/c1-22-18(15-8-3-4-9-16(15)21-22)19(25)23-12-6-5-7-14(23)10-11-20-17(24)13-26-2/h14H,3-13H2,1-2H3,(H,20,24)/t14-/m1/s1.
What are the key properties of 2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide?
2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide has a molecular weight of 362.47 g/mol, XLogP of 1.45, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-[(2R)-1-(2-methyl-4,5,6,7-tetrahydroindazole-3-carbonyl)piperidin-2-yl]ethyl]acetamide is sourced from PubChem (CID 92631951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).