2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide

C17H26N2O3 — CID 124738201

IUPAC2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide
SMILESCOc1cccnc1CC(=O)NCCO[C@@H]1CCCC[C@@H]1C
InChIInChI=1S/C17H26N2O3/c1-13-6-3-4-7-15(13)22-11-10-19-17(20)12-14-16(21-2)8-5-9-18-14/h5,8-9,13,15H,3-4,6-7,10-12H2,1-2H3,(H,19,20)/t13-,15+/m0/s1
InChIKeyQQNGCKKAOHOQDE-DZGCQCFKSA-N
MW306.41 g/mol
LogP2.34
Rot. Bonds7

About 2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide

2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide (PubChem CID 124738201) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is 2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide.

Molecular Properties

Compound Name2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide
PubChem CID124738201
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide
SMILESCOc1cccnc1CC(=O)NCCO[C@@H]1CCCC[C@@H]1C
InChIInChI=1S/C17H26N2O3/c1-13-6-3-4-7-15(13)22-11-10-19-17(20)12-14-16(21-2)8-5-9-18-14/h5,8-9,13,15H,3-4,6-7,10-12H2,1-2H3,(H,19,20)/t13-,15+/m0/s1
InChIKeyQQNGCKKAOHOQDE-DZGCQCFKSA-N
XLogP2.34
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyphenyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide
CID 51948594
N-[2-(2-methylcyclohexyl)oxyethyl]-2-methylsulfanylpyridine-3-carboxamide
CID 42961801
N-[2-(2-methylcyclohexyl)oxyethyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 47036325
N-[2-[(1S,2S)-2-methylcyclohexyl]oxyethyl]-2-(4-pyrazol-1-ylphenyl)acetamide
CID 51948680
N-[2-(4-aminocyclohexyl)oxyethyl]-2-(3-methyl-2-pyridinyl)acetamide
CID 107148439
6-methyl-N-[2-[(1R,2R)-2-methylcyclohexyl]oxyethyl]pyridine-2-carboxamide
CID 51948701
1-[2-(2-methylcyclohexyl)oxyethyl]-3-phenylurea
CID 47034652
5-chloro-N-[2-(2-methylcyclohexyl)oxyethyl]furan-2-carboxamide
CID 51115806
2-(3-methoxy-2-pyridinyl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]acetamide
CID 129432564
4-methyl-N-[2-(2-methylcyclohexyl)oxyethyl]-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 71895393
3-(methoxymethyl)-N-[2-[(1S,2R)-2-methylcyclohexyl]oxyethyl]benzamide
CID 51726082
6-(dimethylamino)-N-[2-[(1S,2R)-2-methylcyclohexyl]oxyethyl]pyridine-3-carboxamide
CID 94131649

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide?
The IUPAC name of 2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide (CID 124738201) is 2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide.
What is the SMILES notation for 2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide?
The canonical SMILES for 2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide is COc1cccnc1CC(=O)NCCO[C@@H]1CCCC[C@@H]1C.
What is the InChIKey of 2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide?
The InChIKey is QQNGCKKAOHOQDE-DZGCQCFKSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-13-6-3-4-7-15(13)22-11-10-19-17(20)12-14-16(21-2)8-5-9-18-14/h5,8-9,13,15H,3-4,6-7,10-12H2,1-2H3,(H,19,20)/t13-,15+/m0/s1.
What are the key properties of 2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide?
2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide has a molecular weight of 306.41 g/mol, XLogP of 2.34, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxy-2-pyridinyl)-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]acetamide is sourced from PubChem (CID 124738201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).