N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine

C15H32N6 — CID 105240944

IUPACN,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine
SMILESCCCn1ncnc1CC(NN)C(C)(CC)N(CC)CC
InChIInChI=1S/C15H32N6/c1-6-10-21-14(17-12-18-21)11-13(19-16)15(5,7-2)20(8-3)9-4/h12-13,19H,6-11,16H2,1-5H3
InChIKeyCIPRJXRIYSNSSR-UHFFFAOYSA-N
MW296.46 g/mol
LogP1.57
Rot. Bonds10

About N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine

N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine (PubChem CID 105240944) has the molecular formula C15H32N6 and a molecular weight of 296.46 g/mol. Its IUPAC name is N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine.

Molecular Properties

Compound NameN,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine
PubChem CID105240944
Molecular FormulaC15H32N6
Molecular Weight296.46 g/mol
Exact Mass296.27
IUPAC NameN,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine
SMILESCCCn1ncnc1CC(NN)C(C)(CC)N(CC)CC
InChIInChI=1S/C15H32N6/c1-6-10-21-14(17-12-18-21)11-13(19-16)15(5,7-2)20(8-3)9-4/h12-13,19H,6-11,16H2,1-5H3
InChIKeyCIPRJXRIYSNSSR-UHFFFAOYSA-N
XLogP1.57
TPSA72.00 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.46
LogP ≤ 51.57
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

[3-methyl-3-piperidin-1-yl-1-(2-propyl-1,2,4-triazol-3-yl)butan-2-yl]hydrazine
CID 105239944
N,N,3-triethyl-1-(2-ethyl-1,2,4-triazol-3-yl)-2-hydrazinylpentan-3-amine
CID 105242029
N,N-diethyl-3-hydrazinyl-2-methyl-4-[2-(2-methylpropyl)-1,2,4-triazol-3-yl]butan-2-amine
CID 105239298
3-N,3-N,3-trimethyl-2-N-propyl-1-(2-propyl-1,2,4-triazol-3-yl)butane-2,3-diamine
CID 79053430
N,N-diethyl-3-hydrazinyl-2-methyl-4-(2-propan-2-yl-1,2,4-triazol-3-yl)butan-2-amine
CID 105239377
1,1,1-trifluoro-3-(2-propyl-1,2,4-triazol-3-yl)propan-2-amine
CID 105002958
3,3-dimethyl-2-[(2-propyl-1,2,4-triazol-3-yl)methyl]butan-1-amine
CID 83138306
N,N-diethyl-2-hydrazinyl-3-methyl-1-(1,3-thiazol-2-yl)pentan-3-amine
CID 105240949
3-ethoxy-3-methyl-N-propyl-1-(2-propyl-1,2,4-triazol-3-yl)butan-2-amine
CID 116727209
[1-(2-ethyl-1,2,4-triazol-3-yl)-3-methyl-3-piperidin-1-ylpentan-2-yl]hydrazine
CID 105241370
1-[1-hydrazinyl-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylcyclohexan-1-amine
CID 105243326
4,4,4-trifluoro-1-(2-propyl-1,2,4-triazol-3-yl)-3-(trifluoromethyl)butan-2-amine
CID 103312099

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine?
The IUPAC name of N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine (CID 105240944) is N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine.
What is the SMILES notation for N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine?
The canonical SMILES for N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine is CCCn1ncnc1CC(NN)C(C)(CC)N(CC)CC.
What is the InChIKey of N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine?
The InChIKey is CIPRJXRIYSNSSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N6/c1-6-10-21-14(17-12-18-21)11-13(19-16)15(5,7-2)20(8-3)9-4/h12-13,19H,6-11,16H2,1-5H3.
What are the key properties of N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine?
N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine has a molecular weight of 296.46 g/mol, XLogP of 1.57, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-hydrazinyl-3-methyl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-3-amine is sourced from PubChem (CID 105240944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).