3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol

C14H24N4O — CID 102875553

IUPAC3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol
SMILESCCc1nc(N)c(C)c(N(CCCO)C2CCC2)n1
InChIInChI=1S/C14H24N4O/c1-3-12-16-13(15)10(2)14(17-12)18(8-5-9-19)11-6-4-7-11/h11,19H,3-9H2,1-2H3,(H2,15,16,17)
InChIKeyUCOASRCYOYCKOX-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.67
Rot. Bonds6

About 3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol

3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol (PubChem CID 102875553) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol.

Molecular Properties

Compound Name3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol
PubChem CID102875553
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol
SMILESCCc1nc(N)c(C)c(N(CCCO)C2CCC2)n1
InChIInChI=1S/C14H24N4O/c1-3-12-16-13(15)10(2)14(17-12)18(8-5-9-19)11-6-4-7-11/h11,19H,3-9H2,1-2H3,(H2,15,16,17)
InChIKeyUCOASRCYOYCKOX-UHFFFAOYSA-N
XLogP1.67
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol
CID 102865835
3-[cyclobutyl-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]propan-1-ol
CID 102875785
3-[(6-chloro-2,5-dimethylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol
CID 102865866
3-[(6-amino-5-ethylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol
CID 102875507
3-[(3-amino-6-methyl-2-pyridinyl)-cyclobutylamino]propan-1-ol
CID 102859402
4-N-cyclopropyl-2-ethyl-5-methyl-4-N-(thiophen-3-ylmethyl)pyrimidine-4,6-diamine
CID 80986678
3-[(5-amino-3-bromo-4-methyl-2-pyridinyl)-cyclobutylamino]propan-1-ol
CID 102859445
3-[cyclobutyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol
CID 102875528
3-[(5-amino-6-methyl-2-pyridinyl)-cyclobutylamino]propan-1-ol
CID 102859337
2-ethyl-4-N,5-dimethyl-4-N-propylpyrimidine-4,6-diamine
CID 80993286
2-[cyclopentyl-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol
CID 80994741
3-[cyclobutyl-(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol
CID 102868602

Frequently Asked Questions

What is the IUPAC name of 3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol?
The IUPAC name of 3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol (CID 102875553) is 3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol.
What is the SMILES notation for 3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol?
The canonical SMILES for 3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol is CCc1nc(N)c(C)c(N(CCCO)C2CCC2)n1.
What is the InChIKey of 3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol?
The InChIKey is UCOASRCYOYCKOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-12-16-13(15)10(2)14(17-12)18(8-5-9-19)11-6-4-7-11/h11,19H,3-9H2,1-2H3,(H2,15,16,17).
What are the key properties of 3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol?
3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol has a molecular weight of 264.37 g/mol, XLogP of 1.67, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol is sourced from PubChem (CID 102875553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).