1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine

C15H30N6 — CID 105243326

IUPAC1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine
SMILESCCCn1ncnc1CC(NN)C1(N(C)C)CCCCC1
InChIInChI=1S/C15H30N6/c1-4-10-21-14(17-12-18-21)11-13(19-16)15(20(2)3)8-6-5-7-9-15/h12-13,19H,4-11,16H2,1-3H3
InChIKeyAHDFCYWJAYWJAF-UHFFFAOYSA-N
MW294.45 g/mol
LogP1.33
Rot. Bonds7

About 1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine

1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine (PubChem CID 105243326) has the molecular formula C15H30N6 and a molecular weight of 294.45 g/mol. Its IUPAC name is 1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine
PubChem CID105243326
Molecular FormulaC15H30N6
Molecular Weight294.45 g/mol
Exact Mass294.25
IUPAC Name1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine
SMILESCCCn1ncnc1CC(NN)C1(N(C)C)CCCCC1
InChIInChI=1S/C15H30N6/c1-4-10-21-14(17-12-18-21)11-13(19-16)15(20(2)3)8-6-5-7-9-15/h12-13,19H,4-11,16H2,1-3H3
InChIKeyAHDFCYWJAYWJAF-UHFFFAOYSA-N
XLogP1.33
TPSA72.00 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.45
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

[1-(1-ethoxycyclopentyl)-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]hydrazine
CID 105275809
N,N-dimethyl-1-[1-(methylamino)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]cyclohexan-1-amine
CID 79066371
1-[1-hydrazinyl-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]-N,N,4-trimethylcyclohexan-1-amine
CID 105243444
[1-(1-ethoxycyclohexyl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine
CID 105276351
1-[1-amino-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcycloheptan-1-amine
CID 79080658
[3-methyl-3-piperidin-1-yl-1-(2-propyl-1,2,4-triazol-3-yl)butan-2-yl]hydrazine
CID 105239944
[2-(2-methyl-1,2,4-triazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)ethyl]hydrazine
CID 105242962
[2-(2-ethyl-1,2,4-triazol-3-yl)-1-(2-methylthiolan-2-yl)ethyl]hydrazine
CID 105318593
[4-methoxy-1-(2-propyl-1,2,4-triazol-3-yl)butan-2-yl]hydrazine
CID 105206476
N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine
CID 105240944
1-[1-(ethylamino)-2-(1-propylimidazol-2-yl)ethyl]-N,N-dimethylcyclopentan-1-amine
CID 79751938
1-[(4-chloro-1-propylpyrazol-5-yl)-hydrazinylmethyl]-N,N-dimethylcyclohexan-1-amine
CID 105243209

Frequently Asked Questions

What is the IUPAC name of 1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine?
The IUPAC name of 1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine (CID 105243326) is 1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine.
What is the SMILES notation for 1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine?
The canonical SMILES for 1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine is CCCn1ncnc1CC(NN)C1(N(C)C)CCCCC1.
What is the InChIKey of 1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine?
The InChIKey is AHDFCYWJAYWJAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N6/c1-4-10-21-14(17-12-18-21)11-13(19-16)15(20(2)3)8-6-5-7-9-15/h12-13,19H,4-11,16H2,1-3H3.
What are the key properties of 1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine?
1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine has a molecular weight of 294.45 g/mol, XLogP of 1.33, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine is sourced from PubChem (CID 105243326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).