5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine

C12H21N5 — CID 80915172

IUPAC5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine
SMILESCCc1c(NN)ncnc1NC1(C)CCCC1
InChIInChI=1S/C12H21N5/c1-3-9-10(14-8-15-11(9)17-13)16-12(2)6-4-5-7-12/h8H,3-7,13H2,1-2H3,(H2,14,15,16,17)
InChIKeyNMBSHRBFRSAYBU-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.07
Rot. Bonds4

About 5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine

5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine (PubChem CID 80915172) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is 5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine
PubChem CID80915172
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC Name5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine
SMILESCCc1c(NN)ncnc1NC1(C)CCCC1
InChIInChI=1S/C12H21N5/c1-3-9-10(14-8-15-11(9)17-13)16-12(2)6-4-5-7-12/h8H,3-7,13H2,1-2H3,(H2,14,15,16,17)
InChIKeyNMBSHRBFRSAYBU-UHFFFAOYSA-N
XLogP2.07
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.07
H-Bond Donors ≤ 53
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

6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine
CID 80819002
1-[[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 80915300
N-(2,2-dimethylcyclohexyl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80929258
N-(2,2-dimethylcyclopentyl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80929757
N-cyclopropyl-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80932555
5-ethyl-4-N-(3-methyloxan-3-yl)pyrimidine-4,6-diamine
CID 114114617
2-ethyl-6-hydrazinyl-5-methyl-N-(1-methylcyclopentyl)pyrimidin-4-amine
CID 81006586
N-(1,1-dioxothian-4-yl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80898843
5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine
CID 80944076
2-ethyl-6-hydrazinyl-5-methyl-N-(1-methylcyclohexyl)pyrimidin-4-amine
CID 81006055
N-(3,5-dimethylcyclohexyl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80915420
5-ethyl-6-hydrazinyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)pyrimidin-4-amine
CID 80909037

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine?
The IUPAC name of 5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine (CID 80915172) is 5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine?
The canonical SMILES for 5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine is CCc1c(NN)ncnc1NC1(C)CCCC1.
What is the InChIKey of 5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine?
The InChIKey is NMBSHRBFRSAYBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-3-9-10(14-8-15-11(9)17-13)16-12(2)6-4-5-7-12/h8H,3-7,13H2,1-2H3,(H2,14,15,16,17).
What are the key properties of 5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine?
5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine has a molecular weight of 235.33 g/mol, XLogP of 2.07, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine is sourced from PubChem (CID 80915172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).