N-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine

C12H21N5 — CID 80910183

IUPACN-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine
SMILESCc1cc(N(C)CC2CCCC2)nc(NN)n1
InChIInChI=1S/C12H21N5/c1-9-7-11(15-12(14-9)16-13)17(2)8-10-5-3-4-6-10/h7,10H,3-6,8,13H2,1-2H3,(H,14,15,16)
InChIKeyYNEIMJQTZNVHSO-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.70
Rot. Bonds4

About N-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine

N-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine (PubChem CID 80910183) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine
PubChem CID80910183
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC NameN-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine
SMILESCc1cc(N(C)CC2CCCC2)nc(NN)n1
InChIInChI=1S/C12H21N5/c1-9-7-11(15-12(14-9)16-13)17(2)8-10-5-3-4-6-10/h7,10H,3-6,8,13H2,1-2H3,(H,14,15,16)
InChIKeyYNEIMJQTZNVHSO-UHFFFAOYSA-N
XLogP1.70
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.70
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

4-N-(cyclopentylmethyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine
CID 80833627
N-(cyclopropylmethyl)-N-ethyl-2-hydrazinyl-6-methylpyrimidin-4-amine
CID 80912871
N-(2,2-dimethylpropyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine
CID 80903777
2-hydrazinyl-N-(2-methoxyethyl)-N,6-dimethylpyrimidin-4-amine
CID 80896244
3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)-methylamino]propanenitrile
CID 80916985
N-benzyl-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine
CID 80918150
2-hydrazinyl-N,6-dimethyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine
CID 80928821
2-hydrazinyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine
CID 80906970
4-N-(cyclohexylmethyl)-6-N-ethyl-4-N-methylpyrimidine-2,4,6-triamine
CID 80799499
2-hydrazinyl-N,6-dimethyl-N-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 80906105
4-N-(cyclobutylmethyl)-2-N,4-N-diethyl-6-methylpyrimidine-2,4-diamine
CID 107403115
N-[(4-chlorophenyl)methyl]-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine
CID 80896376

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine?
The IUPAC name of N-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine (CID 80910183) is N-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine.
What is the SMILES notation for N-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine?
The canonical SMILES for N-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine is Cc1cc(N(C)CC2CCCC2)nc(NN)n1.
What is the InChIKey of N-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine?
The InChIKey is YNEIMJQTZNVHSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-9-7-11(15-12(14-9)16-13)17(2)8-10-5-3-4-6-10/h7,10H,3-6,8,13H2,1-2H3,(H,14,15,16).
What are the key properties of N-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine?
N-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine has a molecular weight of 235.33 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine is sourced from PubChem (CID 80910183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).