1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol

C15H26N4O — CID 80992171

IUPAC1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol
SMILESCCc1nc(N)c(C)c(NCC2(O)CCC(C)CC2)n1
InChIInChI=1S/C15H26N4O/c1-4-12-18-13(16)11(3)14(19-12)17-9-15(20)7-5-10(2)6-8-15/h10,20H,4-9H2,1-3H3,(H3,16,17,18,19)
InChIKeySBCAWUIMWPHDGL-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.28
Rot. Bonds4

About 1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol

1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol (PubChem CID 80992171) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol.

Molecular Properties

Compound Name1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol
PubChem CID80992171
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol
SMILESCCc1nc(N)c(C)c(NCC2(O)CCC(C)CC2)n1
InChIInChI=1S/C15H26N4O/c1-4-12-18-13(16)11(3)14(19-12)17-9-15(20)7-5-10(2)6-8-15/h10,20H,4-9H2,1-3H3,(H3,16,17,18,19)
InChIKeySBCAWUIMWPHDGL-UHFFFAOYSA-N
XLogP2.28
TPSA84.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol with MolForge

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Related Compounds

1-[[(6-amino-2,5-dimethylpyrimidin-4-yl)amino]methyl]-4,4-dimethylcyclohexan-1-ol
CID 80842534
1-[[(6-chloro-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 80977973
2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol
CID 80981938
1-[[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol
CID 80915307
1-[[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol
CID 80915305
1-[[(5-amino-3-methyl-2-pyridinyl)amino]methyl]-4-methylcyclohexan-1-ol
CID 65115492
4-N-butyl-2-ethyl-5-methylpyrimidine-4,6-diamine
CID 80980996
1-[[(4,6-dimethylpyrimidin-2-yl)amino]methyl]-4-methylcyclohexan-1-ol
CID 65118322
4-methyl-1-[[[5-methyl-2-(methylamino)pyrimidin-4-yl]amino]methyl]cyclohexan-1-ol
CID 80842820
1-[[(6-chloro-5-ethylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol
CID 65121660
2-ethyl-5-methyl-4-N-(2,2,2-trifluoroethyl)pyrimidine-4,6-diamine
CID 80981531
4-N-benzyl-2-ethyl-5-methylpyrimidine-4,6-diamine
CID 80980993

Frequently Asked Questions

What is the IUPAC name of 1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol?
The IUPAC name of 1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol (CID 80992171) is 1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol.
What is the SMILES notation for 1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol?
The canonical SMILES for 1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol is CCc1nc(N)c(C)c(NCC2(O)CCC(C)CC2)n1.
What is the InChIKey of 1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol?
The InChIKey is SBCAWUIMWPHDGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-4-12-18-13(16)11(3)14(19-12)17-9-15(20)7-5-10(2)6-8-15/h10,20H,4-9H2,1-3H3,(H3,16,17,18,19).
What are the key properties of 1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol?
1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol has a molecular weight of 278.40 g/mol, XLogP of 2.28, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol is sourced from PubChem (CID 80992171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).