2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine

C14H25N5O — CID 82746566

IUPAC2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine
SMILESCc1c(NN)nc(C(C)(C)C)nc1N(C)C1CCOC1
InChIInChI=1S/C14H25N5O/c1-9-11(18-15)16-13(14(2,3)4)17-12(9)19(5)10-6-7-20-8-10/h10H,6-8,15H2,1-5H3,(H,16,17,18)
InChIKeyHIFGBFSXAFRQDG-UHFFFAOYSA-N
MW279.39 g/mol
LogP1.59
Rot. Bonds3

About 2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine

2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine (PubChem CID 82746566) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is 2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine
PubChem CID82746566
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC Name2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine
SMILESCc1c(NN)nc(C(C)(C)C)nc1N(C)C1CCOC1
InChIInChI=1S/C14H25N5O/c1-9-11(18-15)16-13(14(2,3)4)17-12(9)19(5)10-6-7-20-8-10/h10H,6-8,15H2,1-5H3,(H,16,17,18)
InChIKeyHIFGBFSXAFRQDG-UHFFFAOYSA-N
XLogP1.59
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 51.59
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'}

Analyze 2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-tert-butyl-4-N-cyclopentyl-4-N,6-N,5-trimethylpyrimidine-4,6-diamine
CID 80993102
2-tert-butyl-N-(cyclobutylmethyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine
CID 81006290
3-[[(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-methylamino]methyl]cyclobutan-1-ol
CID 81006464
1-[(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-methylamino]-2-methylpropan-2-ol
CID 81007045
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
2-tert-butyl-4-N-methyl-4-N-(oxolan-3-yl)-6-N-propylpyrimidine-4,6-diamine
CID 82751277
6-hydrazinyl-N-methyl-3-nitro-N-(oxolan-3-yl)pyridin-2-amine
CID 82747704
6-hydrazinyl-N,2,5-trimethyl-N-(oxan-4-ylmethyl)pyrimidin-4-amine
CID 80910084
2-ethyl-6-hydrazinyl-N,5-dimethyl-N-(4-methylcyclohexyl)pyrimidin-4-amine
CID 80994438
1-[(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-methylamino]-3-methoxypropan-2-ol
CID 80995833
3-(aminomethyl)-N,4,6-trimethyl-N-(oxolan-3-yl)pyridin-2-amine
CID 82732656

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine?
The IUPAC name of 2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine (CID 82746566) is 2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine?
The canonical SMILES for 2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine is Cc1c(NN)nc(C(C)(C)C)nc1N(C)C1CCOC1.
What is the InChIKey of 2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine?
The InChIKey is HIFGBFSXAFRQDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-9-11(18-15)16-13(14(2,3)4)17-12(9)19(5)10-6-7-20-8-10/h10H,6-8,15H2,1-5H3,(H,16,17,18).
What are the key properties of 2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine?
2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine has a molecular weight of 279.39 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-hydrazinyl-N,5-dimethyl-N-(oxolan-3-yl)pyrimidin-4-amine is sourced from PubChem (CID 82746566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).