1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine

C16H28N2O — CID 175558533

IUPAC1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine
SMILESCCC[C@@H](N(N)Cc1ccccc1OC)C(C)(C)C
InChIInChI=1S/C16H28N2O/c1-6-9-15(16(2,3)4)18(17)12-13-10-7-8-11-14(13)19-5/h7-8,10-11,15H,6,9,12,17H2,1-5H3/t15-/m1/s1
InChIKeyLGJVDEARTJLJIK-OAHLLOKOSA-N
MW264.41 g/mol
LogP3.59
Rot. Bonds6

About 1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine

1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine (PubChem CID 175558533) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine
PubChem CID175558533
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine
SMILESCCC[C@@H](N(N)Cc1ccccc1OC)C(C)(C)C
InChIInChI=1S/C16H28N2O/c1-6-9-15(16(2,3)4)18(17)12-13-10-7-8-11-14(13)19-5/h7-8,10-11,15H,6,9,12,17H2,1-5H3/t15-/m1/s1
InChIKeyLGJVDEARTJLJIK-OAHLLOKOSA-N
XLogP3.59
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 53.59
H-Bond Donors ≤ 51
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

2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N,3,3-trimethylbutane-1,2-diamine
CID 65483502
1-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-2-N-methylpentane-1,2-diamine
CID 83054110
(2S)-2-amino-N-[(2-methoxyphenyl)methyl]-N,3,3-trimethylbutanamide
CID 61157066
2-N-ethyl-1-N-[(2-methoxyphenyl)methyl]-1-N-methylpentane-1,2-diamine
CID 62043369
1-[(2-methoxyphenyl)methyl-methylamino]ethanol
CID 67668408
1-N-ethyl-1-N-[(2-methoxyphenyl)methyl]hexane-1,2-diamine
CID 91088877
3,3-dimethoxy-2-N-[(2-methoxyphenyl)methyl]-2-N,2-dimethylpropane-1,2-diamine
CID 66179840
1-N-tert-butyl-4-N-[(2-methoxyphenyl)methyl]-4-N-methylpentane-1,4-diamine
CID 62435403
2-[[(2-methoxyphenyl)methyl-methylamino]methyl]-2-methylpentanal
CID 62277579
methyl 2-[(2-methoxyphenyl)methyl-methylamino]hexanoate
CID 115666744
(2R)-2-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N,3,3-trimethylbutanamide
CID 103930088
2-[(2-methoxyphenyl)methyl-methylamino]-2-methylpropan-1-ol
CID 115882414

Frequently Asked Questions

What is the IUPAC name of 1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine?
The IUPAC name of 1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine (CID 175558533) is 1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine.
What is the SMILES notation for 1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine?
The canonical SMILES for 1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine is CCC[C@@H](N(N)Cc1ccccc1OC)C(C)(C)C.
What is the InChIKey of 1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine?
The InChIKey is LGJVDEARTJLJIK-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H28N2O/c1-6-9-15(16(2,3)4)18(17)12-13-10-7-8-11-14(13)19-5/h7-8,10-11,15H,6,9,12,17H2,1-5H3/t15-/m1/s1.
What are the key properties of 1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine?
1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine has a molecular weight of 264.41 g/mol, XLogP of 3.59, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-2,2-dimethylhexan-3-yl]-1-[(2-methoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 175558533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).