1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine

C18H33N3 — CID 105240811

IUPAC1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine
SMILESCCN(CC)C(C)(CC)C(Cc1cc(C)ccc1C)NN
InChIInChI=1S/C18H33N3/c1-7-18(6,21(8-2)9-3)17(20-19)13-16-12-14(4)10-11-15(16)5/h10-12,17,20H,7-9,13,19H2,1-6H3
InChIKeyQRWRAYJZZPBCNV-UHFFFAOYSA-N
MW291.48 g/mol
LogP3.19
Rot. Bonds8

About 1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine

1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine (PubChem CID 105240811) has the molecular formula C18H33N3 and a molecular weight of 291.48 g/mol. Its IUPAC name is 1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine.

Molecular Properties

Compound Name1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine
PubChem CID105240811
Molecular FormulaC18H33N3
Molecular Weight291.48 g/mol
Exact Mass291.27
IUPAC Name1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine
SMILESCCN(CC)C(C)(CC)C(Cc1cc(C)ccc1C)NN
InChIInChI=1S/C18H33N3/c1-7-18(6,21(8-2)9-3)17(20-19)13-16-12-14(4)10-11-15(16)5/h10-12,17,20H,7-9,13,19H2,1-6H3
InChIKeyQRWRAYJZZPBCNV-UHFFFAOYSA-N
XLogP3.19
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.48
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(3,4-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine
CID 105240894
1-(5-chloro-2-fluorophenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine
CID 103053634
[1-chloro-3-(2,5-dimethylphenyl)-1,1-difluoropropan-2-yl]hydrazine
CID 105265366
1-(2-chloro-3-fluorophenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine
CID 105240791
1-(3-chloro-2-fluorophenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine
CID 102867916
1-(2,5-dimethylphenyl)-3-methoxy-3-methyl-N-propylpentan-2-amine
CID 116758355
N,N-diethyl-1-(2-fluoro-5-methylphenyl)-1-hydrazinyl-2-methylbutan-2-amine
CID 105240808
1-(2,5-dimethylphenyl)-2-N,2-N-diethyl-2-methylbutane-1,2-diamine
CID 79069136
1-(4-chloro-3-fluorophenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine
CID 107895162
3-(2,5-dimethylphenyl)-1,1,1-trifluoro-N-methylpropan-2-amine
CID 115802743
[1-(2,5-dimethylphenyl)-4,4,4-trifluorobutan-2-yl]hydrazine
CID 105205901
1-(3,4-dimethylphenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine
CID 105240604

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine?
The IUPAC name of 1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine (CID 105240811) is 1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine.
What is the SMILES notation for 1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine?
The canonical SMILES for 1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine is CCN(CC)C(C)(CC)C(Cc1cc(C)ccc1C)NN.
What is the InChIKey of 1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine?
The InChIKey is QRWRAYJZZPBCNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N3/c1-7-18(6,21(8-2)9-3)17(20-19)13-16-12-14(4)10-11-15(16)5/h10-12,17,20H,7-9,13,19H2,1-6H3.
What are the key properties of 1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine?
1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine has a molecular weight of 291.48 g/mol, XLogP of 3.19, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine is sourced from PubChem (CID 105240811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).