4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol

C14H23N3O2 — CID 66327648

IUPAC4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
SMILESCCC1CCC(O)(CNc2cc(OC)ncn2)CC1
InChIInChI=1S/C14H23N3O2/c1-3-11-4-6-14(18,7-5-11)9-15-12-8-13(19-2)17-10-16-12/h8,10-11,18H,3-7,9H2,1-2H3,(H,15,16,17)
InChIKeySVLSGNNAGZAWOI-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.23
Rot. Bonds5

About 4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol

4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol (PubChem CID 66327648) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
PubChem CID66327648
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
SMILESCCC1CCC(O)(CNc2cc(OC)ncn2)CC1
InChIInChI=1S/C14H23N3O2/c1-3-11-4-6-14(18,7-5-11)9-15-12-8-13(19-2)17-10-16-12/h8,10-11,18H,3-7,9H2,1-2H3,(H,15,16,17)
InChIKeySVLSGNNAGZAWOI-UHFFFAOYSA-N
XLogP2.23
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol with MolForge

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Related Compounds

(3R*,4R*)-3-cyclopropyl-1-(6-methoxy-4-pyrimidinyl)-4-methyl-3-pyrrolidinol
CID 72866606
(5S)-5-ethyl-5-heptan-4-yl-N-(6-methoxypyrimidin-4-yl)-4H-1,3-oxazol-2-amine
CID 89677836
[1-Amino-1-[4-[6-(2-hydroxyethylamino)pyrimidin-4-yl]oxycyclohexyl]-2-methylpropan-2-yl] formate
CID 155191200
1-[[(4-Methoxypyrimidin-2-yl)amino]methyl]-3-methylcyclohexan-1-ol
CID 53542945
1-[[(4,6-Dimethoxypyrimidin-5-yl)methylamino]methyl]cyclohexan-1-ol
CID 65107423
1-[[(4,6-Dimethoxypyrimidin-5-yl)methylamino]methyl]-4-methylcyclohexan-1-ol
CID 65117893
4-Ethyl-1-[(6-methoxypyrimidin-4-yl)amino]cyclohexane-1-carboxylic acid
CID 66317831
N-[1-(aminomethyl)cyclohexyl]-6-methoxypyrimidin-4-amine
CID 66318099
2-[1-[[(6-Methoxypyrimidin-4-yl)amino]methyl]cyclohexyl]acetic acid
CID 66318282
N-[1-(aminomethyl)-3-methylcyclohexyl]-6-methoxypyrimidin-4-amine
CID 66318318
N-[1-(aminomethyl)-4-methylcyclohexyl]-6-methoxypyrimidin-4-amine
CID 66318319
N-[(2-aminocyclohexyl)methyl]-6-methoxypyrimidin-4-amine
CID 66318546

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol (CID 66327648) is 4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol is CCC1CCC(O)(CNc2cc(OC)ncn2)CC1.
What is the InChIKey of 4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol?
The InChIKey is SVLSGNNAGZAWOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-3-11-4-6-14(18,7-5-11)9-15-12-8-13(19-2)17-10-16-12/h8,10-11,18H,3-7,9H2,1-2H3,(H,15,16,17).
What are the key properties of 4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol?
4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol has a molecular weight of 265.36 g/mol, XLogP of 2.23, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 66327648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).