2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide

C18H24N2O2 — CID 4916617

IUPAC2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide
SMILESCOc1ccc(NC(=O)CC23CC4CC(CC(C4)C2)C3)cn1
InChIInChI=1S/C18H24N2O2/c1-22-17-3-2-15(11-19-17)20-16(21)10-18-7-12-4-13(8-18)6-14(5-12)9-18/h2-3,11-14H,4-10H2,1H3,(H,20,21)
InChIKeyLBVKMHJRJJQUPM-UHFFFAOYSA-N
MW300.40 g/mol
LogP3.64
Rot. Bonds4

About 2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide

2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide (PubChem CID 4916617) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide
PubChem CID4916617
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide
SMILESCOc1ccc(NC(=O)CC23CC4CC(CC(C4)C2)C3)cn1
InChIInChI=1S/C18H24N2O2/c1-22-17-3-2-15(11-19-17)20-16(21)10-18-7-12-4-13(8-18)6-14(5-12)9-18/h2-3,11-14H,4-10H2,1H3,(H,20,21)
InChIKeyLBVKMHJRJJQUPM-UHFFFAOYSA-N
XLogP3.64
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-N-(pyridin-3-yl)acetamide
CID 799060
2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxypyridin-3-yl)acetamide
CID 4878967
N-(2-aminophenyl)-4-[[(6-methoxy-3-pyridinyl)amino]methyl]benzamide
CID 10450420
4-[[2-Methyl-2-[(5-morpholin-4-yl-2-pyridinyl)oxy]propanoyl]amino]adamantane-1-carboxamide
CID 11532312
Adamantan-1-yl-[2-(6-methoxy-pyridin-3-yl)-cyclopropyl]-methanone
CID 25066817
5-[[3-(2-cyanopropan-2-yl)benzoyl]amino]-N-(6-methoxy-3-pyridinyl)-2-methylbenzamide
CID 44571964
N-(6-methoxypyridin-3-yl)-2,2-diphenylacetamide
CID 1506493
N-[1-[(6-methoxy-3-pyridinyl)amino]-4-methyl-1-oxopentan-2-yl]-2-methylbenzamide
CID 2998498
N-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-pyridin-3-ylethyl}cyclohexanecarboxamide
CID 3240844
(E)-N-(6-methoxy-3-pyridinyl)-3-phenylprop-2-enamide
CID 7478550
N-[(1S)-5-(2-amino-2-oxoethyl)-2-adamantyl]-2-methyl-2-[(5-morpholin-4-yl-2-pyridinyl)oxy]propanamide
CID 44418395
N-((1R,2S,5R,7S)-5-carbamoylmethyl-adamantan-2-yl)-2-methyl-2-[5-(4-methyl-piperazin-1-yl)-pyridin-2-yloxy]-propionamide
CID 44418396

Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide?
The IUPAC name of 2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide (CID 4916617) is 2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide?
The canonical SMILES for 2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide is COc1ccc(NC(=O)CC23CC4CC(CC(C4)C2)C3)cn1.
What is the InChIKey of 2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide?
The InChIKey is LBVKMHJRJJQUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-22-17-3-2-15(11-19-17)20-16(21)10-18-7-12-4-13(8-18)6-14(5-12)9-18/h2-3,11-14H,4-10H2,1H3,(H,20,21).
What are the key properties of 2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide?
2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide has a molecular weight of 300.40 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantyl)-N-(6-methoxy-3-pyridinyl)acetamide is sourced from PubChem (CID 4916617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).