N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

C13H25N7O — CID 104830689

IUPACN-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCC(Nc1nc(NN)nc(N2CCOCC2)n1)C(C)(C)C
InChIInChI=1S/C13H25N7O/c1-9(13(2,3)4)15-10-16-11(19-14)18-12(17-10)20-5-7-21-8-6-20/h9H,5-8,14H2,1-4H3,(H2,15,16,17,18,19)
InChIKeyMQFLBXWXSBRPBF-UHFFFAOYSA-N
MW295.39 g/mol
LogP0.84
Rot. Bonds4

About N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 104830689) has the molecular formula C13H25N7O and a molecular weight of 295.39 g/mol. Its IUPAC name is N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID104830689
Molecular FormulaC13H25N7O
Molecular Weight295.39 g/mol
Exact Mass295.21
IUPAC NameN-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCC(Nc1nc(NN)nc(N2CCOCC2)n1)C(C)(C)C
InChIInChI=1S/C13H25N7O/c1-9(13(2,3)4)15-10-16-11(19-14)18-12(17-10)20-5-7-21-8-6-20/h9H,5-8,14H2,1-4H3,(H2,15,16,17,18,19)
InChIKeyMQFLBXWXSBRPBF-UHFFFAOYSA-N
XLogP0.84
TPSA101.22 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 50.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80931558
N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 34253082
N-(2,2-dimethylbutyl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 103466763
4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80904883
2-N-butan-2-yl-4-N-ethyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80765648
N-butyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80931737
4-hydrazinyl-N-(2-methylsulfonylethyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80898859
4-chloro-6-morpholin-4-yl-N-propan-2-yl-1,3,5-triazin-2-amine
CID 759895
4-N-ethyl-6-morpholin-4-yl-2-N-pentan-3-yl-1,3,5-triazine-2,4-diamine
CID 80750303
(2S)-2-[(4-amino-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]-3-methylbutan-1-ol
CID 80848988
N-butyl-4-hydrazinyl-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80916546
6-morpholin-4-yl-2-N-propan-2-yl-4-N-prop-2-enyl-1,3,5-triazine-2,4-diamine
CID 6488389

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 104830689) is N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is CC(Nc1nc(NN)nc(N2CCOCC2)n1)C(C)(C)C.
What is the InChIKey of N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is MQFLBXWXSBRPBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N7O/c1-9(13(2,3)4)15-10-16-11(19-14)18-12(17-10)20-5-7-21-8-6-20/h9H,5-8,14H2,1-4H3,(H2,15,16,17,18,19).
What are the key properties of N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 295.39 g/mol, XLogP of 0.84, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 104830689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).