2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide

C22H26N2O2 — CID 121197067

IUPAC2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide
SMILESO=C(CC12CC3CC(CC(C3)C1)C2)NCc1cncc(-c2ccco2)c1
InChIInChI=1S/C22H26N2O2/c25-21(11-22-8-15-4-16(9-22)6-17(5-15)10-22)24-13-18-7-19(14-23-12-18)20-2-1-3-26-20/h1-3,7,12,14-17H,4-6,8-11,13H2,(H,24,25)
InChIKeyNDMJOXBSYADAPH-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.56
Rot. Bonds5

About 2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide

2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide (PubChem CID 121197067) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide.

Molecular Properties

Compound Name2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide
PubChem CID121197067
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide
SMILESO=C(CC12CC3CC(CC(C3)C1)C2)NCc1cncc(-c2ccco2)c1
InChIInChI=1S/C22H26N2O2/c25-21(11-22-8-15-4-16(9-22)6-17(5-15)10-22)24-13-18-7-19(14-23-12-18)20-2-1-3-26-20/h1-3,7,12,14-17H,4-6,8-11,13H2,(H,24,25)
InChIKeyNDMJOXBSYADAPH-UHFFFAOYSA-N
XLogP4.56
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[5-(furan-2-yl)-3-pyridinyl]methyl]-2-pyrrol-1-ylacetamide
CID 121197083
2-(1-adamantyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]acetamide
CID 121198813
N-[[5-(furan-2-yl)-3-pyridinyl]methyl]-2-phenylmethoxyacetamide
CID 121197178
N-[[5-(furan-2-yl)-3-pyridinyl]methyl]-2-(4-methoxyphenyl)acetamide
CID 121196995
3-[[5-(furan-2-yl)-3-pyridinyl]methyl]-1,1-dimethylurea
CID 121197182
2-(1-adamantyl)-N-benzylacetamide
CID 3560004
2-(1-adamantyl)-N-[2-oxo-2-(pyridin-3-ylmethylamino)ethyl]acetamide
CID 35512081
4-bromo-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]thiophene-2-carboxamide
CID 119105467
1-(3,4-dichlorophenyl)-3-[[5-(furan-2-yl)-3-pyridinyl]methyl]urea
CID 121197225
3-(4-cyanophenyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]propanamide
CID 121197060
2-bromo-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]benzamide
CID 121197121
N-[[5-(furan-2-yl)-3-pyridinyl]methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 121022646

Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide?
The IUPAC name of 2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide (CID 121197067) is 2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide.
What is the SMILES notation for 2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide?
The canonical SMILES for 2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide is O=C(CC12CC3CC(CC(C3)C1)C2)NCc1cncc(-c2ccco2)c1.
What is the InChIKey of 2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide?
The InChIKey is NDMJOXBSYADAPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c25-21(11-22-8-15-4-16(9-22)6-17(5-15)10-22)24-13-18-7-19(14-23-12-18)20-2-1-3-26-20/h1-3,7,12,14-17H,4-6,8-11,13H2,(H,24,25).
What are the key properties of 2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide?
2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide has a molecular weight of 350.46 g/mol, XLogP of 4.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantyl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide is sourced from PubChem (CID 121197067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).