1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine

C16H31N5 — CID 103026902

IUPAC1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine
SMILESCC1CCC(C(CCc2cnn(C)c2)NN)(N(C)C)CC1
InChIInChI=1S/C16H31N5/c1-13-7-9-16(10-8-13,20(2)3)15(19-17)6-5-14-11-18-21(4)12-14/h11-13,15,19H,5-10,17H2,1-4H3
InChIKeyFJWWHTGBOOFTRL-UHFFFAOYSA-N
MW293.46 g/mol
LogP1.70
Rot. Bonds6

About 1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine

1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine (PubChem CID 103026902) has the molecular formula C16H31N5 and a molecular weight of 293.46 g/mol. Its IUPAC name is 1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine
PubChem CID103026902
Molecular FormulaC16H31N5
Molecular Weight293.46 g/mol
Exact Mass293.26
IUPAC Name1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine
SMILESCC1CCC(C(CCc2cnn(C)c2)NN)(N(C)C)CC1
InChIInChI=1S/C16H31N5/c1-13-7-9-16(10-8-13,20(2)3)15(19-17)6-5-14-11-18-21(4)12-14/h11-13,15,19H,5-10,17H2,1-4H3
InChIKeyFJWWHTGBOOFTRL-UHFFFAOYSA-N
XLogP1.70
TPSA59.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.46
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'}

Analyze 1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N,4-trimethyl-1-[1-(methylamino)-3-(1-methylpyrazol-4-yl)propyl]cyclohexan-1-amine
CID 103011177
N,N,3-trimethyl-1-[1-(methylamino)-3-(1-methylpyrazol-4-yl)propyl]cyclohexan-1-amine
CID 103011187
[1-(1-methoxy-3-methylcyclohexyl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 103027134
1-[1-hydrazinyl-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]-N,N,4-trimethylcyclohexan-1-amine
CID 105243444
[1-(1-methoxycyclopentyl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 103027057
1-(1-hydrazinylhexyl)-N,N,4-trimethylcyclohexan-1-amine
CID 105243536
[1-cycloheptyl-3-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 103025788
1-(2-cyclopentyl-1-hydrazinylethyl)-N,N,4-trimethylcyclohexan-1-amine
CID 105243419
[3-(1-methylpyrazol-4-yl)-1-(1-phenylcyclobutyl)propyl]hydrazine
CID 103026722
1-(1-methoxy-4-methylcyclohexyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103008613
3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-amine
CID 103007104
4-methyl-1-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine
CID 62126227

Frequently Asked Questions

What is the IUPAC name of 1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine?
The IUPAC name of 1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine (CID 103026902) is 1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine.
What is the SMILES notation for 1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine?
The canonical SMILES for 1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine is CC1CCC(C(CCc2cnn(C)c2)NN)(N(C)C)CC1.
What is the InChIKey of 1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine?
The InChIKey is FJWWHTGBOOFTRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N5/c1-13-7-9-16(10-8-13,20(2)3)15(19-17)6-5-14-11-18-21(4)12-14/h11-13,15,19H,5-10,17H2,1-4H3.
What are the key properties of 1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine?
1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine has a molecular weight of 293.46 g/mol, XLogP of 1.70, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-hydrazinyl-3-(1-methylpyrazol-4-yl)propyl]-N,N,4-trimethylcyclohexan-1-amine is sourced from PubChem (CID 103026902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).