4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol

C14H24N4O — CID 135098110

IUPAC4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol
SMILESCCc1cnc(C)nc1NCC1(O)CCN(C)CC1
InChIInChI=1S/C14H24N4O/c1-4-12-9-15-11(2)17-13(12)16-10-14(19)5-7-18(3)8-6-14/h9,19H,4-8,10H2,1-3H3,(H,15,16,17)
InChIKeyGUTZFGMREYPTJB-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.22
Rot. Bonds4

About 4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol

4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol (PubChem CID 135098110) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol.

Molecular Properties

Compound Name4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol
PubChem CID135098110
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol
SMILESCCc1cnc(C)nc1NCC1(O)CCN(C)CC1
InChIInChI=1S/C14H24N4O/c1-4-12-9-15-11(2)17-13(12)16-10-14(19)5-7-18(3)8-6-14/h9,19H,4-8,10H2,1-3H3,(H,15,16,17)
InChIKeyGUTZFGMREYPTJB-UHFFFAOYSA-N
XLogP1.22
TPSA61.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]piperidin-3-ol;dihydrochloride
CID 154916752
2-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]adamantan-2-ol
CID 134702570
[1-[[(2-methyl-5-propylpyrimidin-4-yl)amino]methyl]cyclobutyl]methanol
CID 131905026
N-[(1,4-dimethylpiperidin-4-yl)methyl]-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 107165617
4-[(1,4-dimethylpiperidin-4-yl)methylamino]pyrimidine-5-carboxylic acid
CID 114214734
1-(5-ethyl-2-methylpyrimidin-4-yl)-4-(imidazol-1-ylmethyl)piperidin-4-ol
CID 50977781
N-ethyl-N'-(5-ethyl-2-methylpyrimidin-4-yl)-N,2-dimethylpropane-1,3-diamine
CID 135105473
methyl 4-[(1-ethylcyclopropyl)methylamino]-2-methylpyrimidine-5-carboxylate
CID 114214814
ethyl 2-[(1,4-dimethylpiperidin-4-yl)methylamino]pyridine-3-carboxylate
CID 107164465
3-[(1,4-dimethylpiperidin-4-yl)methylamino]pyrazine-2-carbonitrile
CID 113362481
1-[[(2,5-dimethylpyrimidin-4-yl)amino]methyl]cyclobutane-1-carboxylic acid
CID 166243260
1-[[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 133447647

Frequently Asked Questions

What is the IUPAC name of 4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol?
The IUPAC name of 4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol (CID 135098110) is 4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol.
What is the SMILES notation for 4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol?
The canonical SMILES for 4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol is CCc1cnc(C)nc1NCC1(O)CCN(C)CC1.
What is the InChIKey of 4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol?
The InChIKey is GUTZFGMREYPTJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-4-12-9-15-11(2)17-13(12)16-10-14(19)5-7-18(3)8-6-14/h9,19H,4-8,10H2,1-3H3,(H,15,16,17).
What are the key properties of 4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol?
4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol has a molecular weight of 264.37 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]-1-methylpiperidin-4-ol is sourced from PubChem (CID 135098110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).