N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine

C13H23N5 — CID 80655142

IUPACN-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine
SMILESCc1cc(NN)nc(CN(C)C2CCCCC2)n1
InChIInChI=1S/C13H23N5/c1-10-8-12(17-14)16-13(15-10)9-18(2)11-6-4-3-5-7-11/h8,11H,3-7,9,14H2,1-2H3,(H,15,16,17)
InChIKeyQGZWZAQYUGMNRS-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.84
Rot. Bonds4

About N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine

N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine (PubChem CID 80655142) has the molecular formula C13H23N5 and a molecular weight of 249.36 g/mol. Its IUPAC name is N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine.

Molecular Properties

Compound NameN-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine
PubChem CID80655142
Molecular FormulaC13H23N5
Molecular Weight249.36 g/mol
Exact Mass249.20
IUPAC NameN-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine
SMILESCc1cc(NN)nc(CN(C)C2CCCCC2)n1
InChIInChI=1S/C13H23N5/c1-10-8-12(17-14)16-13(15-10)9-18(2)11-6-4-3-5-7-11/h8,11H,3-7,9,14H2,1-2H3,(H,15,16,17)
InChIKeyQGZWZAQYUGMNRS-UHFFFAOYSA-N
XLogP1.84
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methyloxan-4-amine
CID 80655656
2-[[cyclopentyl(methyl)amino]methyl]-N-ethyl-6-methylpyrimidin-4-amine
CID 80658200
N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methyl-1,1-dioxothiolan-3-amine
CID 80656296
N-[(4-chloro-6-methylpyrimidin-2-yl)methyl]-N-methylcycloheptanamine
CID 80664231
2-[cyclobutyl-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]amino]ethanol
CID 102870654
N-[(6-hydrazinyl-2-pyridinyl)methyl]-N-methylcyclohexanamine
CID 79243666
N-[(6-hydrazinyl-2-pyridinyl)methyl]-N-methylcycloheptanamine
CID 79243284
N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-2-yl)methanamine
CID 80656005
1-[[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl-methylamino]methyl]-N,N-dimethylcyclobutan-1-amine
CID 105417038
2-[[cyclopentyl(ethyl)amino]methyl]-N,6-dimethylpyrimidin-4-amine
CID 80657640
N,6-dimethyl-2-[[methyl(oxolan-3-yl)amino]methyl]pyrimidin-4-amine
CID 82743511
[2-(azocan-1-ylmethyl)-6-methylpyrimidin-4-yl]hydrazine
CID 80656209

Frequently Asked Questions

What is the IUPAC name of N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine?
The IUPAC name of N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine (CID 80655142) is N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine.
What is the SMILES notation for N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine?
The canonical SMILES for N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine is Cc1cc(NN)nc(CN(C)C2CCCCC2)n1.
What is the InChIKey of N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine?
The InChIKey is QGZWZAQYUGMNRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5/c1-10-8-12(17-14)16-13(15-10)9-18(2)11-6-4-3-5-7-11/h8,11H,3-7,9,14H2,1-2H3,(H,15,16,17).
What are the key properties of N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine?
N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine has a molecular weight of 249.36 g/mol, XLogP of 1.84, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylcyclohexanamine is sourced from PubChem (CID 80655142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).