3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol

C11H18N4O — CID 106137975

IUPAC3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol
SMILESCNc1cc(NCC2CCC(O)C2)ncn1
InChIInChI=1S/C11H18N4O/c1-12-10-5-11(15-7-14-10)13-6-8-2-3-9(16)4-8/h5,7-9,16H,2-4,6H2,1H3,(H2,12,13,14,15)
InChIKeyXNWGLMYTAOJZSQ-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.09
Rot. Bonds4

About 3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol

3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol (PubChem CID 106137975) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol
PubChem CID106137975
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol
SMILESCNc1cc(NCC2CCC(O)C2)ncn1
InChIInChI=1S/C11H18N4O/c1-12-10-5-11(15-7-14-10)13-6-8-2-3-9(16)4-8/h5,7-9,16H,2-4,6H2,1H3,(H2,12,13,14,15)
InChIKeyXNWGLMYTAOJZSQ-UHFFFAOYSA-N
XLogP1.09
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol 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-[[[2-(methylamino)-4-pyridinyl]amino]methyl]cyclopentan-1-ol
CID 106138027
3-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 104917710
3-[[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclohexan-1-ol
CID 106138429
4-[[(6-bromopyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 106137378
4-[[(6-methylsulfanylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 106130861
3-[[(6-fluoropyrimidin-4-yl)amino]methyl]cyclobutan-1-ol
CID 115417135
3-[[(6-propan-2-ylpyrimidin-4-yl)amino]methyl]cyclobutan-1-ol
CID 66006560
3-[[(6-ethoxypyrimidin-4-yl)amino]methyl]cyclobutan-1-ol
CID 66331001
3-[(pyrazin-2-ylamino)methyl]cyclopentan-1-ol
CID 103269740
3-[[[6-(methylamino)-5-nitropyrimidin-4-yl]amino]methyl]cyclopentan-1-ol
CID 103269696
N-[(3-aminocyclopentyl)methyl]-6-methylpyrimidin-4-amine
CID 106126678
3-[[(6-hydrazinyl-2-methylsulfanylpyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 106138701

Frequently Asked Questions

What is the IUPAC name of 3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol?
The IUPAC name of 3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol (CID 106137975) is 3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol is CNc1cc(NCC2CCC(O)C2)ncn1.
What is the InChIKey of 3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol?
The InChIKey is XNWGLMYTAOJZSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-12-10-5-11(15-7-14-10)13-6-8-2-3-9(16)4-8/h5,7-9,16H,2-4,6H2,1H3,(H2,12,13,14,15).
What are the key properties of 3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol?
3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol has a molecular weight of 222.29 g/mol, XLogP of 1.09, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[[6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 106137975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).