[2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine

C15H24N4O2 — CID 107353045

IUPAC[2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine
SMILESCCC1(C)CCN(Cc2cccc([N+](=O)[O-])c2NN)CC1
InChIInChI=1S/C15H24N4O2/c1-3-15(2)7-9-18(10-8-15)11-12-5-4-6-13(19(20)21)14(12)17-16/h4-6,17H,3,7-11,16H2,1-2H3
InChIKeyQOPLEQKLBSLCAV-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.89
Rot. Bonds5

About [2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine

[2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine (PubChem CID 107353045) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is [2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine.

Molecular Properties

Compound Name[2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine
PubChem CID107353045
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name[2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine
SMILESCCC1(C)CCN(Cc2cccc([N+](=O)[O-])c2NN)CC1
InChIInChI=1S/C15H24N4O2/c1-3-15(2)7-9-18(10-8-15)11-12-5-4-6-13(19(20)21)14(12)17-16/h4-6,17H,3,7-11,16H2,1-2H3
InChIKeyQOPLEQKLBSLCAV-UHFFFAOYSA-N
XLogP2.89
TPSA84.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[2-[(7,7-dimethyl-1,4-thiazepan-4-yl)methyl]-6-nitrophenyl]hydrazine
CID 107459272
[2-[(4-ethylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine
CID 107352957
[2-nitro-6-[(4-propan-2-ylpiperidin-1-yl)methyl]phenyl]hydrazine
CID 107353157
[2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine
CID 107395035
2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-N-ethyl-6-nitroaniline
CID 107351459
4-[(2-hydrazinyl-3-nitrophenyl)methyl]piperazin-2-one
CID 107352999
4,4-dimethyl-1-[(2-nitrophenyl)methyl]piperidine
CID 174618434
[2-nitro-6-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)phenyl]hydrazine
CID 107353090
1-[(2-hydrazinyl-3-nitrophenyl)methyl]-3,4-dimethylpyrrolidine-2,5-dione
CID 107353246
N-ethyl-2-nitro-6-[(1-oxo-1,4-thiazinan-4-yl)methyl]aniline
CID 107351012
4-methyl-1-[(2-nitrophenyl)methyl]piperidin-4-ol
CID 80702501
1-[(2-hydrazinyl-3-nitrophenyl)methyl]-3-propylimidazol-2-one
CID 107353254

Frequently Asked Questions

What is the IUPAC name of [2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine?
The IUPAC name of [2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine (CID 107353045) is [2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine.
What is the SMILES notation for [2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine?
The canonical SMILES for [2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine is CCC1(C)CCN(Cc2cccc([N+](=O)[O-])c2NN)CC1.
What is the InChIKey of [2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine?
The InChIKey is QOPLEQKLBSLCAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-3-15(2)7-9-18(10-8-15)11-12-5-4-6-13(19(20)21)14(12)17-16/h4-6,17H,3,7-11,16H2,1-2H3.
What are the key properties of [2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine?
[2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine has a molecular weight of 292.38 g/mol, XLogP of 2.89, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-6-nitrophenyl]hydrazine is sourced from PubChem (CID 107353045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).