2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol

C15H25N3O — CID 114765171

IUPAC2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol
SMILESCc1cc(CN)cc(N(CCO)C2CCCCC2)n1
InChIInChI=1S/C15H25N3O/c1-12-9-13(11-16)10-15(17-12)18(7-8-19)14-5-3-2-4-6-14/h9-10,14,19H,2-8,11,16H2,1H3
InChIKeyRSMIBIPPZZLZQA-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.98
Rot. Bonds5

About 2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol

2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol (PubChem CID 114765171) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol.

Molecular Properties

Compound Name2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol
PubChem CID114765171
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol
SMILESCc1cc(CN)cc(N(CCO)C2CCCCC2)n1
InChIInChI=1S/C15H25N3O/c1-12-9-13(11-16)10-15(17-12)18(7-8-19)14-5-3-2-4-6-14/h9-10,14,19H,2-8,11,16H2,1H3
InChIKeyRSMIBIPPZZLZQA-UHFFFAOYSA-N
XLogP1.98
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol 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

3-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclobutylamino]propan-1-ol
CID 102859672
4-(aminomethyl)-N-cyclohexyl-N-ethyl-6-methylpyridin-2-amine
CID 113379299
2-[cyclopentyl(2-hydroxyethyl)amino]-6-methylpyridine-4-carbothioamide
CID 114767464
2-[[4-(aminomethyl)-2-pyridinyl]-cyclohexylamino]ethanol
CID 54994992
2-[(6-chloro-2-methylpyrimidin-4-yl)-cyclohexylamino]ethanol
CID 55080382
2-[cyclobutyl(2-hydroxyethyl)amino]-6-methylpyridine-4-carboximidamide
CID 102863039
2-[cyclohexyl-(2,6-diaminopyrimidin-4-yl)amino]ethanol
CID 80810818
2-[(6-amino-2-methylsulfanylpyrimidin-4-yl)-cyclohexylamino]ethanol
CID 80811563
N'-cyclohexyl-N'-(2,6-dimethylpyrimidin-4-yl)propane-1,3-diamine
CID 54939100
[2-[cyclopropyl(2-methoxyethyl)amino]-6-methyl-4-pyridinyl]methanol
CID 113378741
2-[(6-amino-2-propan-2-ylpyrimidin-4-yl)-cyclohexylamino]ethanol
CID 80961504
2-[[6-tert-butyl-4-(hydroxymethyl)-2-pyridinyl]-cyclobutylamino]ethanol
CID 102869293

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol?
The IUPAC name of 2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol (CID 114765171) is 2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol.
What is the SMILES notation for 2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol?
The canonical SMILES for 2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol is Cc1cc(CN)cc(N(CCO)C2CCCCC2)n1.
What is the InChIKey of 2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol?
The InChIKey is RSMIBIPPZZLZQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-12-9-13(11-16)10-15(17-12)18(7-8-19)14-5-3-2-4-6-14/h9-10,14,19H,2-8,11,16H2,1H3.
What are the key properties of 2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol?
2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol has a molecular weight of 263.38 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(aminomethyl)-6-methyl-2-pyridinyl]-cyclohexylamino]ethanol is sourced from PubChem (CID 114765171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).