2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol

C15H27N5O — CID 86285413

IUPAC2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol
SMILESCCc1c(C)nc(N)nc1NCC1CCCN(CCO)C1
InChIInChI=1S/C15H27N5O/c1-3-13-11(2)18-15(16)19-14(13)17-9-12-5-4-6-20(10-12)7-8-21/h12,21H,3-10H2,1-2H3,(H3,16,17,18,19)
InChIKeyLARUNIYMHMYCLF-UHFFFAOYSA-N
MW293.41 g/mol
LogP1.05
Rot. Bonds6

About 2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol

2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol (PubChem CID 86285413) has the molecular formula C15H27N5O and a molecular weight of 293.41 g/mol. Its IUPAC name is 2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol.

Molecular Properties

Compound Name2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol
PubChem CID86285413
Molecular FormulaC15H27N5O
Molecular Weight293.41 g/mol
Exact Mass293.22
IUPAC Name2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol
SMILESCCc1c(C)nc(N)nc1NCC1CCCN(CCO)C1
InChIInChI=1S/C15H27N5O/c1-3-13-11(2)18-15(16)19-14(13)17-9-12-5-4-6-20(10-12)7-8-21/h12,21H,3-10H2,1-2H3,(H3,16,17,18,19)
InChIKeyLARUNIYMHMYCLF-UHFFFAOYSA-N
XLogP1.05
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 51.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]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

[1-[3-[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]propyl]piperidin-3-yl]methanol
CID 72912546
5-[3-(ethylaminomethyl)piperidin-1-yl]pentan-1-ol
CID 63848813
2-[(3R)-3-[[(1-methyl-6-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol
CID 95871772
2-[3-[(4,6-dimethylpyrimidin-2-yl)methyl]piperidin-1-yl]ethanol
CID 110089825
1-[3-[(2-amino-6-ethyl-5-methylpyrimidin-4-yl)amino]propyl]piperidine-3-carboxamide
CID 72913557
(3R)-1-[3-[(2-amino-6-ethyl-5-methylpyrimidin-4-yl)amino]propyl]piperidine-3-carboxamide
CID 97143743
N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-yl]methyl]ethanamine
CID 112589860
6-methyl-2-N-[(1-methylpiperidin-3-yl)methyl]pyridine-2,3-diamine
CID 81132211
4-[3-(ethylaminomethyl)piperidin-1-yl]-2-methylbutan-2-ol
CID 79354793
3-methyl-2-N-[(1-methylpiperidin-3-yl)methyl]pyridine-2,5-diamine
CID 55080788
2-[3-[[[2-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-5-fluoropyrimidin-4-yl]amino]methyl]piperidin-1-yl]ethanol
CID 67285971
2-(3-aminopiperidin-1-yl)ethanol
CID 61296854

Frequently Asked Questions

What is the IUPAC name of 2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol?
The IUPAC name of 2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol (CID 86285413) is 2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol.
What is the SMILES notation for 2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol?
The canonical SMILES for 2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol is CCc1c(C)nc(N)nc1NCC1CCCN(CCO)C1.
What is the InChIKey of 2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol?
The InChIKey is LARUNIYMHMYCLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-3-13-11(2)18-15(16)19-14(13)17-9-12-5-4-6-20(10-12)7-8-21/h12,21H,3-10H2,1-2H3,(H3,16,17,18,19).
What are the key properties of 2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol?
2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol has a molecular weight of 293.41 g/mol, XLogP of 1.05, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[[(2-amino-5-ethyl-6-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]ethanol is sourced from PubChem (CID 86285413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).