1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol

C16H26N2O2 — CID 116756726

IUPAC1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol
SMILESCCOC(C1CCCCC1)C(O)c1cc(C)cnc1N
InChIInChI=1S/C16H26N2O2/c1-3-20-15(12-7-5-4-6-8-12)14(19)13-9-11(2)10-18-16(13)17/h9-10,12,14-15,19H,3-8H2,1-2H3,(H2,17,18)
InChIKeyKJRKFOXYBWAGSS-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.99
Rot. Bonds5

About 1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol

1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol (PubChem CID 116756726) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol.

Molecular Properties

Compound Name1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol
PubChem CID116756726
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol
SMILESCCOC(C1CCCCC1)C(O)c1cc(C)cnc1N
InChIInChI=1S/C16H26N2O2/c1-3-20-15(12-7-5-4-6-8-12)14(19)13-9-11(2)10-18-16(13)17/h9-10,12,14-15,19H,3-8H2,1-2H3,(H2,17,18)
InChIKeyKJRKFOXYBWAGSS-UHFFFAOYSA-N
XLogP2.99
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol 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

2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol
CID 116756745
3-[cyclooctyl(propylamino)methyl]-5-methylpyridin-2-amine
CID 80610949
2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol
CID 116712968
3-[cyclooctyl(hydrazinyl)methyl]-5-methylpyridin-2-amine
CID 105255255
3-[cyclooctyl(methylamino)methyl]-5-methylpyridin-2-amine
CID 80604124
3-(1-amino-2-cyclohexyl-2-ethoxyethyl)pyridin-2-amine
CID 116772126
1-(2-amino-5-methyl-3-pyridinyl)propane-1,2-diol
CID 103452733
2-cyclohexyl-1-(3,5-difluorophenyl)-2-ethoxyethanol
CID 116756591
2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol
CID 116756693
3-(2-cyclopropyl-1-hydrazinyl-2-methoxyethyl)-5-methylpyridin-2-amine
CID 105272937
3-(1-amino-2-cyclopropylethyl)-5-methylpyridin-2-amine
CID 55295743
3-(1-amino-2-ethoxy-3-methylbutyl)-5-methylpyridin-2-amine
CID 116720727

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol?
The IUPAC name of 1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol (CID 116756726) is 1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol.
What is the SMILES notation for 1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol?
The canonical SMILES for 1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol is CCOC(C1CCCCC1)C(O)c1cc(C)cnc1N.
What is the InChIKey of 1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol?
The InChIKey is KJRKFOXYBWAGSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-3-20-15(12-7-5-4-6-8-12)14(19)13-9-11(2)10-18-16(13)17/h9-10,12,14-15,19H,3-8H2,1-2H3,(H2,17,18).
What are the key properties of 1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol?
1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol has a molecular weight of 278.40 g/mol, XLogP of 2.99, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol is sourced from PubChem (CID 116756726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).