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

C14H25N5O — CID 81007386

IUPAC2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
SMILESCCc1nc(NN)c(C)c(NCC2CCCCC2O)n1
InChIInChI=1S/C14H25N5O/c1-3-12-17-13(9(2)14(18-12)19-15)16-8-10-6-4-5-7-11(10)20/h10-11,20H,3-8,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyGQRMDAUEBNIHCK-UHFFFAOYSA-N
MW279.39 g/mol
LogP1.60
Rot. Bonds5

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

2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol (PubChem CID 81007386) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is 2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
PubChem CID81007386
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC Name2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
SMILESCCc1nc(NN)c(C)c(NCC2CCCCC2O)n1
InChIInChI=1S/C14H25N5O/c1-3-12-17-13(9(2)14(18-12)19-15)16-8-10-6-4-5-7-11(10)20/h10-11,20H,3-8,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyGQRMDAUEBNIHCK-UHFFFAOYSA-N
XLogP1.60
TPSA96.09 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 51.60
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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

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Related Compounds

[2-[[(6-chloro-2-ethyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 80977885
2-ethyl-N-[(1-ethylpiperidin-4-yl)methyl]-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 81007566
N-(cyclohexylmethyl)-6-hydrazinyl-5-methyl-2-propylpyrimidin-4-amine
CID 80995285
1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol
CID 81006562
2-[[(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 80915508
6-chloro-2-ethyl-5-methyl-N-[(2-methylcyclohexyl)methyl]pyrimidin-4-amine
CID 80972304
2-[[(6-amino-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 80841458
[2-[[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 80937943
4-N-(cyclopentylmethyl)-2-ethyl-5-methyl-6-N-propylpyrimidine-4,6-diamine
CID 80994212
2-tert-butyl-6-hydrazinyl-5-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine
CID 107421345
2-[[(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 80924426
4-N-(cyclopropylmethyl)-6-N,2-diethyl-5-methylpyrimidine-4,6-diamine
CID 80982187

Frequently Asked Questions

What is the IUPAC name of 2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol (CID 81007386) is 2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol is CCc1nc(NN)c(C)c(NCC2CCCCC2O)n1.
What is the InChIKey of 2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol?
The InChIKey is GQRMDAUEBNIHCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-3-12-17-13(9(2)14(18-12)19-15)16-8-10-6-4-5-7-11(10)20/h10-11,20H,3-8,15H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol?
2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol has a molecular weight of 279.39 g/mol, XLogP of 1.60, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 81007386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).