4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol

C14H22N4O — CID 115265146

IUPAC4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
SMILESOC1CCC(Nc2cc(NC3CCC3)ncn2)CC1
InChIInChI=1S/C14H22N4O/c19-12-6-4-11(5-7-12)18-14-8-13(15-9-16-14)17-10-2-1-3-10/h8-12,19H,1-7H2,(H2,15,16,17,18)
InChIKeyWFHUXJGLCWABNA-UHFFFAOYSA-N
MW262.36 g/mol
LogP2.16
Rot. Bonds4

About 4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol

4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol (PubChem CID 115265146) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
PubChem CID115265146
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
SMILESOC1CCC(Nc2cc(NC3CCC3)ncn2)CC1
InChIInChI=1S/C14H22N4O/c19-12-6-4-11(5-7-12)18-14-8-13(15-9-16-14)17-10-2-1-3-10/h8-12,19H,1-7H2,(H2,15,16,17,18)
InChIKeyWFHUXJGLCWABNA-UHFFFAOYSA-N
XLogP2.16
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 52.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol with MolForge

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Related Compounds

4-[(6-bromopyrimidin-4-yl)amino]cyclohexan-1-ol
CID 104966810
4-[(6-fluoropyrimidin-4-yl)amino]cyclohexan-1-ol
CID 104966807
6-N-cyclohexyl-4-N-cyclopropylpyrimidine-4,6-diamine
CID 112854680
1-[6-(cyclobutylamino)pyrimidin-4-yl]piperidin-4-ol
CID 115265259
N-cyclobutyl-6-methylpyrimidin-4-amine
CID 62416944
cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol
CID 130643849
4-[[6-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 95763811
6-N-cyclobutyl-4-N-pyrrolidin-3-ylpyrimidine-4,6-diamine
CID 115264180
1-[6-(cyclopropylamino)pyrimidin-4-yl]piperidin-3-ol
CID 66569760
4-[(4-methyl-2-pyridinyl)amino]cyclohexan-1-ol
CID 58548584
2-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]-2-methylpropanoic acid
CID 115264300
4-[(5-chloro-4-iodo-2-pyridinyl)amino]cyclohexan-1-ol
CID 66937023

Frequently Asked Questions

What is the IUPAC name of 4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol?
The IUPAC name of 4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol (CID 115265146) is 4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol.
What is the SMILES notation for 4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol?
The canonical SMILES for 4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol is OC1CCC(Nc2cc(NC3CCC3)ncn2)CC1.
What is the InChIKey of 4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol?
The InChIKey is WFHUXJGLCWABNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c19-12-6-4-11(5-7-12)18-14-8-13(15-9-16-14)17-10-2-1-3-10/h8-12,19H,1-7H2,(H2,15,16,17,18).
What are the key properties of 4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol?
4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol has a molecular weight of 262.36 g/mol, XLogP of 2.16, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol is sourced from PubChem (CID 115265146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).