2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine

C15H29N5O — CID 81006164

IUPAC2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine
SMILESCCN(c1nc(C(C)(C)C)nc(NN)c1C)C(C)COC
InChIInChI=1S/C15H29N5O/c1-8-20(10(2)9-21-7)13-11(3)12(19-16)17-14(18-13)15(4,5)6/h10H,8-9,16H2,1-7H3,(H,17,18,19)
InChIKeyGHMAKNLTHIGKFW-UHFFFAOYSA-N
MW295.43 g/mol
LogP2.23
Rot. Bonds6

About 2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine

2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine (PubChem CID 81006164) has the molecular formula C15H29N5O and a molecular weight of 295.43 g/mol. Its IUPAC name is 2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine
PubChem CID81006164
Molecular FormulaC15H29N5O
Molecular Weight295.43 g/mol
Exact Mass295.24
IUPAC Name2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine
SMILESCCN(c1nc(C(C)(C)C)nc(NN)c1C)C(C)COC
InChIInChI=1S/C15H29N5O/c1-8-20(10(2)9-21-7)13-11(3)12(19-16)17-14(18-13)15(4,5)6/h10H,8-9,16H2,1-7H3,(H,17,18,19)
InChIKeyGHMAKNLTHIGKFW-UHFFFAOYSA-N
XLogP2.23
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

1-[(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-methylamino]-3-methoxypropan-2-ol
CID 80995833
4-N,6-N-diethyl-4-N-(1-methoxypropan-2-yl)-5-methyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80983477
2-tert-butyl-6-hydrazinyl-5-methyl-N,N-dipropylpyrimidin-4-amine
CID 81000249
1-[(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-methylamino]propan-2-ol
CID 81006399
1-[(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-methylamino]-2-methylpropan-2-ol
CID 81007045
2-tert-butyl-6-hydrazinyl-N-(4-methoxybutyl)-5-methylpyrimidin-4-amine
CID 81006868
4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-methyl-1H-imidazole-4,5-diamine
CID 114995342
N-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 81007223
[2-tert-butyl-5-methyl-6-(2-propoxyethoxy)pyrimidin-4-yl]hydrazine
CID 81001737
2-tert-butyl-6-hydrazinyl-5-methyl-N-(3-methylbutyl)pyrimidin-4-amine
CID 81001260
2-N-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 82950187
2-tert-butyl-N-(3-ethylpentan-3-yl)-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 81007026

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine?
The IUPAC name of 2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine (CID 81006164) is 2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine.
What is the SMILES notation for 2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine?
The canonical SMILES for 2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine is CCN(c1nc(C(C)(C)C)nc(NN)c1C)C(C)COC.
What is the InChIKey of 2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine?
The InChIKey is GHMAKNLTHIGKFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N5O/c1-8-20(10(2)9-21-7)13-11(3)12(19-16)17-14(18-13)15(4,5)6/h10H,8-9,16H2,1-7H3,(H,17,18,19).
What are the key properties of 2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine?
2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine has a molecular weight of 295.43 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-N-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine is sourced from PubChem (CID 81006164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).