2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol

C13H25N5O2 — CID 114212333

IUPAC2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol
SMILESCCCc1nc(NN)c(C)c(NC(CO)CCOC)n1
InChIInChI=1S/C13H25N5O2/c1-4-5-11-16-12(9(2)13(17-11)18-14)15-10(8-19)6-7-20-3/h10,19H,4-8,14H2,1-3H3,(H2,15,16,17,18)
InChIKeyAYWFCBVMSFYTDH-UHFFFAOYSA-N
MW283.38 g/mol
LogP0.83
Rot. Bonds9

About 2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol

2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol (PubChem CID 114212333) has the molecular formula C13H25N5O2 and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol.

Molecular Properties

Compound Name2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol
PubChem CID114212333
Molecular FormulaC13H25N5O2
Molecular Weight283.38 g/mol
Exact Mass283.20
IUPAC Name2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol
SMILESCCCc1nc(NN)c(C)c(NC(CO)CCOC)n1
InChIInChI=1S/C13H25N5O2/c1-4-5-11-16-12(9(2)13(17-11)18-14)15-10(8-19)6-7-20-3/h10,19H,4-8,14H2,1-3H3,(H2,15,16,17,18)
InChIKeyAYWFCBVMSFYTDH-UHFFFAOYSA-N
XLogP0.83
TPSA105.32 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 50.83
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-3-methoxypropan-1-ol
CID 106198990
6-hydrazinyl-N-(1-methoxypentan-2-yl)-2,5-dimethylpyrimidin-4-amine
CID 80918200
N-(3,3-dimethylbutan-2-yl)-6-hydrazinyl-5-methyl-2-propylpyrimidin-4-amine
CID 113458137
6-hydrazinyl-N-(1-methoxybutan-2-yl)-2,5-dimethylpyrimidin-4-amine
CID 80918272
6-hydrazinyl-5-methyl-N-(4-methylhexan-2-yl)-2-propylpyrimidin-4-amine
CID 81007165
N-(1-cyclohexylethyl)-6-hydrazinyl-5-methyl-2-propylpyrimidin-4-amine
CID 81007115
[6-[2-(3-methoxypropoxy)ethoxy]-5-methyl-2-propylpyrimidin-4-yl]hydrazine
CID 103176603
6-hydrazinyl-5-methyl-N-(2-methylpropyl)-2-propylpyrimidin-4-amine
CID 81001135
[6-ethyl-2-(2-methoxyethyl)-5-methylpyrimidin-4-yl]hydrazine
CID 63560256
2-[(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propane-1,3-diol
CID 81007643
6-hydrazinyl-N-(2-methoxy-2-methylpropyl)-5-methyl-2-propylpyrimidin-4-amine
CID 113451063
2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methylpentan-1-ol
CID 114156614

Frequently Asked Questions

What is the IUPAC name of 2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol?
The IUPAC name of 2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol (CID 114212333) is 2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol.
What is the SMILES notation for 2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol?
The canonical SMILES for 2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol is CCCc1nc(NN)c(C)c(NC(CO)CCOC)n1.
What is the InChIKey of 2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol?
The InChIKey is AYWFCBVMSFYTDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N5O2/c1-4-5-11-16-12(9(2)13(17-11)18-14)15-10(8-19)6-7-20-3/h10,19H,4-8,14H2,1-3H3,(H2,15,16,17,18).
What are the key properties of 2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol?
2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol has a molecular weight of 283.38 g/mol, XLogP of 0.83, 9 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]-4-methoxybutan-1-ol is sourced from PubChem (CID 114212333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).