5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine

C13H23N5 — CID 80944076

IUPAC5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine
SMILESCCc1c(NN)ncnc1NC1CCC(C)CC1
InChIInChI=1S/C13H23N5/c1-3-11-12(15-8-16-13(11)18-14)17-10-6-4-9(2)5-7-10/h8-10H,3-7,14H2,1-2H3,(H2,15,16,17,18)
InChIKeyPVRBOYXWOZDSCP-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.32
Rot. Bonds4

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

5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine (PubChem CID 80944076) has the molecular formula C13H23N5 and a molecular weight of 249.36 g/mol. Its IUPAC name is 5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine
PubChem CID80944076
Molecular FormulaC13H23N5
Molecular Weight249.36 g/mol
Exact Mass249.20
IUPAC Name5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine
SMILESCCc1c(NN)ncnc1NC1CCC(C)CC1
InChIInChI=1S/C13H23N5/c1-3-11-12(15-8-16-13(11)18-14)17-10-6-4-9(2)5-7-10/h8-10H,3-7,14H2,1-2H3,(H2,15,16,17,18)
InChIKeyPVRBOYXWOZDSCP-UHFFFAOYSA-N
XLogP2.32
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.32
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

N-cyclopropyl-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80932555
N-(3,5-dimethylcyclohexyl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80915420
6-chloro-5-ethyl-N-(4-methylcyclohexyl)pyrimidin-4-amine
CID 63729756
N-(1,1-dioxothian-4-yl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80898843
4-[(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]cyclohexan-1-ol
CID 80932109
6-hydrazinyl-5-propyl-N-(4-propylcyclohexyl)pyrimidin-4-amine
CID 80901761
1-[[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]methyl]-4-methylcyclohexan-1-ol
CID 80915305
4-N-cyclopentyl-6-N,5-diethylpyrimidine-4,6-diamine
CID 80770074
6-chloro-N-cyclopropyl-5-ethylpyrimidin-4-amine
CID 63734410
6-hydrazinyl-N-(1-methylpiperidin-4-yl)-5-propylpyrimidin-4-amine
CID 80895120
4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine
CID 80827503
N-(2,2-dimethylcyclopentyl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80929757

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine?
The IUPAC name of 5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine (CID 80944076) is 5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine?
The canonical SMILES for 5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine is CCc1c(NN)ncnc1NC1CCC(C)CC1.
What is the InChIKey of 5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine?
The InChIKey is PVRBOYXWOZDSCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5/c1-3-11-12(15-8-16-13(11)18-14)17-10-6-4-9(2)5-7-10/h8-10H,3-7,14H2,1-2H3,(H2,15,16,17,18).
What are the key properties of 5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine?
5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 2.32, 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-(4-methylcyclohexyl)pyrimidin-4-amine is sourced from PubChem (CID 80944076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).